data_2rok_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 2rok _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 ' 437' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? . . . . . 0 N--CA 1.483 1.2 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.44 -19.04 63.09 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.575 1.15 . . . . 0.0 113.906 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -96.98 12.35 32.77 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.143 2.177 . . . . 0.0 113.528 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 45.2 t -120.55 142.56 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.248 1.419 . . . . 0.0 110.995 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 96.3 mt -113.35 163.48 14.8 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 127.201 2.201 . . . . 0.0 111.352 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -123.0 138.71 54.62 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 127.043 2.137 . . . . 0.0 107.433 167.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 8.1 t -133.03 137.74 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.794 1.237 . . . . 0.0 109.017 -169.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 15.8 m -127.35 135.52 50.63 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.816 1.246 . . . . 0.0 109.754 -178.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -158.08 158.61 30.12 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.772 1.229 . . . . 0.0 112.303 -169.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.42 148.12 34.87 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.844 3.029 . . . . 0.0 113.17 168.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -58.87 -16.16 16.07 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.737 1.755 . . . . 0.0 115.737 -176.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -82.36 -14.71 54.84 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.31 1.444 . . . . 0.0 113.948 177.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -62.62 148.72 45.41 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.129 0.877 . . . . 0.0 112.134 173.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -129.69 165.91 20.9 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.962 1.705 . . . . 0.0 111.781 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 m -50.51 -36.06 32.29 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.765 1.226 . . . . 0.0 112.42 172.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.1 m -65.89 -41.54 91.39 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 175.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -64.82 -31.61 72.92 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.737 -0.602 . . . . 0.0 111.18 173.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.62 -46.29 54.83 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.103 0.961 . . . . 0.0 111.573 177.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -58.55 -38.33 77.59 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.23 -0.919 . . . . 0.0 112.48 169.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -67.2 -39.74 86.38 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.908 0.776 . . . . 0.0 112.879 175.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 41.7 tp -65.54 -44.16 87.72 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.792 1.237 . . . . 0.0 111.687 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -95.36 6.9 47.79 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -175.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 8.7 t -55.18 -26.67 40.52 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.181 1.393 . . . . 0.0 113.413 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -61.06 -10.56 6.29 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.689 1.595 . . . . 0.0 114.973 174.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -122.68 8.03 9.46 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.501 1.52 . . . . 0.0 113.543 -174.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 80.8 -145.8 26.38 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 121.239 -0.913 . . . . 0.0 113.213 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -63.31 144.03 57.3 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.076 0.95 . . . . 0.0 112.401 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.9 pt -144.95 175.72 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 126.335 1.854 . . . . 0.0 111.491 -175.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -136.16 150.35 49.01 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.47 1.508 . . . . 0.0 109.392 168.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 69.0 mt -133.58 133.49 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.208 1.403 . . . . 0.0 109.227 -171.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 42.7 m -136.13 100.51 4.43 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.658 1.583 . . . . 0.0 111.196 -177.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -59.8 151.06 26.42 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 32.1 pt -135.09 -20.12 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 124.837 1.255 . . . . 0.0 113.622 169.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -152.37 -179.12 7.27 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.66 1.184 . . . . 0.0 112.104 175.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.33 -25.66 68.14 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.888 1.275 . . . . 0.0 112.719 170.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.7 p -125.29 4.13 7.78 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.949 1.699 . . . . 0.0 114.026 -169.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 93.4 p -154.58 156.16 36.05 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 172.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.84 160.18 42.1 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.954 1.702 . . . . 0.0 111.459 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -90.86 150.99 21.32 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.525 0.73 . . . . 0.0 110.108 167.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 68.6 t -138.66 126.6 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 124.855 1.262 . . . . 0.0 109.896 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 9.4 t -95.28 137.38 34.41 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.504 1.122 . . . . 0.0 111.253 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 71.9 mt -122.54 158.75 29.2 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.066 1.747 . . . . 0.0 110.177 177.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 99.0 p -80.67 -9.85 59.77 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -171.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -145.74 151.09 45.27 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.109 1.364 . . . . 0.0 111.915 177.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -71.57 -19.52 28.09 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.209 2.606 . . . . 0.0 113.308 172.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -65.13 -40.3 94.25 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.683 -1.261 . . . . 0.0 111.677 170.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -64.93 -39.04 92.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.734 0.814 . . . . 0.0 111.401 175.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 23.1 t -56.84 -50.71 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.368 1.067 . . . . 0.0 111.173 170.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -60.48 -41.69 94.73 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.391 0.541 . . . . 0.0 112.311 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 81.1 mt -62.62 -47.11 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.862 0.865 . . . . 0.0 111.28 175.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.55 -40.71 97.68 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 119.232 0.923 . . . . 0.0 112.874 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 77.9 t -66.97 -34.01 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.184 0.994 . . . . 0.0 112.172 175.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -70.28 -46.43 64.37 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.114 -0.991 . . . . 0.0 112.221 173.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 24.0 p -73.81 -25.22 59.99 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -174.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 53.7 p -66.4 -19.71 65.87 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -57.39 -22.38 42.46 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.813 1.245 . . . . 0.0 113.746 174.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -98.5 -5.62 31.88 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.198 1.399 . . . . 0.0 113.42 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -77.17 145.5 37.64 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.482 1.113 . . . . 0.0 112.562 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -129.76 0.46 4.87 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.908 1.283 . . . . 0.0 114.286 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 46.6 m -126.61 0.86 6.84 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.809 1.644 . . . . 0.0 112.986 177.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -161.22 171.63 18.1 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.524 2.33 . . . . 0.0 109.741 175.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 18.3 tpp85 -148.64 155.13 40.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.855 1.262 . . . . 0.0 111.127 169.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 73.9 mt -134.66 141.59 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.052 1.741 . . . . 0.0 109.387 -173.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -145.96 168.68 20.28 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.259 1.824 . . . . 0.0 110.557 172.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 30.4 p -71.62 163.03 28.52 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 120.662 -1.274 . . . . 0.0 112.347 173.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -57.21 -40.8 78.18 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.263 -0.898 . . . . 0.0 111.733 169.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.73 85.12 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.763 0.825 . . . . 0.0 113.03 177.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.38 -42.31 96.21 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.235 -0.916 . . . . 0.0 112.212 171.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 90.4 t80 . . . . . 0 CA--C 1.542 0.635 0 CA-C-N 119.03 0.832 . . . . 0.0 111.989 174.873 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.9 mmt-85 . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -58.74 -19.54 41.23 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.161 1.384 . . . . 0.0 113.731 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -115.34 16.61 16.76 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.588 2.355 . . . . 0.0 112.904 -175.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 42.9 t -123.1 138.47 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.677 1.191 . . . . 0.0 112.165 -170.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 76.8 mt -118.22 164.3 15.38 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 127.191 2.196 . . . . 0.0 110.839 175.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -118.09 141.96 47.92 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.802 2.041 . . . . 0.0 107.908 167.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.7 t -133.16 139.25 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.556 1.542 . . . . 0.0 109.107 -171.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.5 m -128.14 134.87 49.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.346 1.458 . . . . 0.0 109.594 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -158.32 158.58 29.85 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.715 1.206 . . . . 0.0 111.539 -170.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -66.17 151.16 84.31 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.061 1.841 . . . . 0.0 111.065 169.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -60.65 -11.72 8.14 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -66.68 -19.81 65.84 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.47 1.108 . . . . 0.0 113.522 171.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -73.61 153.31 40.24 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.285 1.034 . . . . 0.0 112.758 175.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 173.46 11.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.6 1.96 . . . . 0.0 111.691 175.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 m -49.12 -35.77 17.25 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.197 1.399 . . . . 0.0 112.395 171.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.7 m -64.5 -43.31 94.51 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 176.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -65.92 -31.61 72.64 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.653 -0.654 . . . . 0.0 111.187 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.0 mt -71.44 -43.7 66.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.868 0.867 . . . . 0.0 111.502 175.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -58.68 -42.43 88.51 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.943 -1.098 . . . . 0.0 111.753 169.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -62.81 -33.82 76.02 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 119.035 0.834 . . . . 0.0 112.971 176.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.2 tp -73.37 -29.93 62.95 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.789 1.236 . . . . 0.0 113.369 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -121.06 -0.2 10.06 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -169.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 78.0 p -56.88 -23.91 48.03 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 176.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -57.71 -17.07 13.03 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.469 1.508 . . . . 0.0 114.545 174.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -99.56 3.71 45.54 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.218 1.407 . . . . 0.0 113.99 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.67 -44.1 3.04 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.955 1.741 . . . . 0.0 115.817 168.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -150.16 133.84 16.7 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.878 1.271 . . . . 0.0 110.594 177.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.9 pt -146.1 173.25 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.018 1.327 . . . . 0.0 112.101 -172.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 62.8 tp60 -139.92 139.1 36.1 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.002 1.321 . . . . 0.0 108.817 167.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 71.8 mt -112.94 132.36 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.11 1.364 . . . . 0.0 108.279 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 57.9 m -141.03 95.97 2.93 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.258 1.423 . . . . 0.0 111.095 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -57.97 152.68 15.81 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -177.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 37.7 pt -134.26 -19.8 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 125.21 1.404 . . . . 0.0 113.398 169.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -153.64 178.27 10.04 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.733 1.213 . . . . 0.0 111.994 174.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -63.61 -17.42 62.86 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.36 1.864 . . . . 0.0 112.733 171.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.2 p -135.07 7.59 3.42 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 127.197 2.199 . . . . 0.0 113.64 -171.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 4.0 m -149.66 146.37 27.23 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.21 1.004 . . . . 0.0 113.693 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.44 158.98 43.4 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.189 1.395 . . . . 0.0 112.04 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -90.38 152.75 20.86 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.75 0.82 . . . . 0.0 109.726 167.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.0 t -136.11 115.05 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 C-N-CA 124.231 1.012 . . . . 0.0 110.42 173.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 24.0 m -79.21 143.36 35.42 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.248 1.419 . . . . 0.0 109.831 169.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 76.7 mt -119.7 161.6 20.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.938 1.295 . . . . 0.0 111.092 175.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 21.1 t -60.32 -34.84 74.39 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.627 1.171 . . . . 0.0 113.673 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -140.32 151.53 64.55 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 125.179 1.392 . . . . 0.0 111.684 -177.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -69.21 -23.71 32.99 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.129 2.553 . . . . 0.0 113.868 -178.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.72 -33.64 75.53 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 120.863 -1.148 . . . . 0.0 112.387 173.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -66.1 -27.71 68.26 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.284 1.033 . . . . 0.0 112.785 -179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 90.0 t -61.93 -46.56 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.776 1.23 . . . . 0.0 110.617 173.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -63.53 -41.25 98.48 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.642 0.777 . . . . 0.0 111.699 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.32 -51.32 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.652 0.781 . . . . 0.0 110.528 175.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.89 90.88 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.8 t -62.77 -36.72 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 O-C-N 121.025 -1.047 . . . . 0.0 111.754 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -73.11 -30.57 63.74 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -91.48 -33.06 15.35 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -176.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 90.0 p -70.08 -17.75 63.24 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 50.7 pttt -59.93 -12.07 7.0 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.162 1.541 . . . . 0.0 115.162 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -101.01 1.31 39.44 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.898 1.679 . . . . 0.0 113.968 178.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -61.85 159.26 14.2 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.63 1.172 . . . . 0.0 113.958 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.82 -1.93 2.18 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.033 1.333 . . . . 0.0 114.57 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 78.2 p -140.81 1.48 1.69 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.446 1.498 . . . . 0.0 114.172 -176.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -156.75 175.43 14.07 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.038 2.135 . . . . 0.0 109.983 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 76.6 ttt-85 -145.85 150.89 36.98 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.351 1.46 . . . . 0.0 110.895 172.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 85.0 mt -131.88 144.93 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 126.18 1.792 . . . . 0.0 109.577 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -150.27 169.27 21.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.735 1.614 . . . . 0.0 110.747 169.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 59.9 p -71.06 162.63 29.1 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 120.815 -1.178 . . . . 0.0 112.229 174.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -58.13 -37.57 74.86 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 121.386 -0.821 . . . . 0.0 112.085 169.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.71 -38.39 89.05 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.76 0.824 . . . . 0.0 113.0 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -67.66 -39.18 84.56 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.117 -0.989 . . . . 0.0 112.545 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 26.2 t80 . . . . . 0 CA--C 1.544 0.733 0 C-N-CA 123.775 0.83 . . . . 0.0 111.737 172.654 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -63.53 -23.85 67.56 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.569 1.147 . . . . 0.0 113.442 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -93.71 17.57 11.65 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 127.502 2.321 . . . . 0.0 113.584 176.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 24.6 t -126.52 135.88 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.813 1.245 . . . . 0.0 111.399 -170.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 89.7 mt -103.11 167.0 10.11 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.693 1.997 . . . . 0.0 111.8 174.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -122.95 135.69 54.58 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 127.376 2.27 . . . . 0.0 107.224 167.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.4 t -131.35 140.16 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.797 1.239 . . . . 0.0 109.084 -171.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 9.9 m -131.18 136.62 48.45 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.041 1.336 . . . . 0.0 109.76 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -158.91 158.74 29.34 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.477 1.111 . . . . 0.0 112.415 -169.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -53.79 148.72 35.89 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.79 2.993 . . . . 0.0 113.281 169.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -61.11 -9.33 4.44 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -85.02 -12.23 53.62 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.333 1.453 . . . . 0.0 113.931 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 7.9 m95 -63.61 157.7 23.17 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -131.52 162.93 29.11 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.577 1.951 . . . . 0.0 111.651 -178.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.6 m -52.74 -35.95 56.96 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.763 1.225 . . . . 0.0 111.999 169.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.2 m -66.37 -41.52 89.34 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.496 0.925 . . . . 0.0 113.496 176.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -65.28 -30.68 71.57 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.792 -0.567 . . . . 0.0 111.393 173.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 62.0 mt -70.71 -47.31 60.45 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.867 0.867 . . . . 0.0 111.479 175.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -58.41 -38.93 78.4 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.99 -1.069 . . . . 0.0 112.452 170.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -65.91 -39.34 90.5 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.072 0.851 . . . . 0.0 112.844 175.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.38 -33.84 75.53 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.243 1.417 . . . . 0.0 112.11 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -110.85 9.8 22.47 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.711 1.374 . . . . 0.0 114.711 -174.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 32.8 m -57.97 -22.06 47.38 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 121.03 -1.044 . . . . 0.0 113.771 173.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.08 -15.23 12.8 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.435 1.494 . . . . 0.0 114.685 171.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -113.33 4.01 16.19 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.587 1.555 . . . . 0.0 113.627 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.68 -44.95 2.82 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 126.0 1.762 . . . . 0.0 115.242 172.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -153.3 144.38 22.97 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.826 1.25 . . . . 0.0 111.894 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 15.4 pt -145.35 176.03 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 126.349 1.86 . . . . 0.0 111.611 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -136.85 145.23 44.17 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.944 1.298 . . . . 0.0 109.415 168.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 76.2 mt -123.51 134.51 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.438 1.095 . . . . 0.0 110.051 -169.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.4 m -134.33 96.89 3.69 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 126.216 1.806 . . . . 0.0 109.966 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -55.83 155.8 5.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.475 1.11 . . . . 0.0 113.88 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 12.7 mt -128.49 -39.07 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.967 1.307 . . . . 0.0 109.959 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -153.67 -172.4 4.22 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.71 1.604 . . . . 0.0 110.52 174.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -63.93 -17.75 63.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.687 1.195 . . . . 0.0 113.073 172.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.9 p -127.41 2.87 6.28 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 126.433 1.893 . . . . 0.0 114.332 -169.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 80.1 p -153.73 153.92 33.11 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.94 151.73 31.6 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.45 1.5 . . . . 0.0 111.86 -179.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -89.59 145.87 24.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.936 0.894 . . . . 0.0 108.86 167.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.4 t -137.88 111.26 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.86 0.864 . . . . 0.0 110.984 -176.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 66.5 m -75.87 138.31 41.0 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.917 1.687 . . . . 0.0 110.955 171.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 49.5 mt -112.61 163.39 14.58 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.303 1.041 . . . . 0.0 112.199 178.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 17.6 t -64.37 -34.04 77.25 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.252 1.021 . . . . 0.0 113.318 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -141.11 149.49 55.69 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.333 1.453 . . . . 0.0 111.21 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.44 -24.65 26.32 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.95 2.433 . . . . 0.0 113.991 -177.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.52 -27.03 68.17 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.754 -1.216 . . . . 0.0 113.39 174.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -67.43 -26.14 66.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.434 1.094 . . . . 0.0 112.272 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.5 t -61.78 -45.38 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.936 1.294 . . . . 0.0 110.257 176.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.25 -39.63 92.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.79 0.836 . . . . 0.0 111.825 177.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 99.3 mt -60.96 -49.67 83.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 123.91 0.884 . . . . 0.0 110.573 175.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.15 93.42 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 74.8 t -63.66 -40.62 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.427 -0.795 . . . . 0.0 110.961 173.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -64.05 -45.13 90.17 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.889 0.768 . . . . 0.0 112.836 175.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -72.9 -27.5 61.92 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -176.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 31.7 p -62.77 -19.76 64.31 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -60.07 -12.6 8.64 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.245 1.418 . . . . 0.0 114.011 171.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -121.0 12.09 11.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.009 1.723 . . . . 0.0 112.699 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.72 164.37 10.0 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.661 1.185 . . . . 0.0 113.061 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -132.98 -13.37 2.81 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.141 1.376 . . . . 0.0 113.085 178.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 71.1 p -145.84 7.71 1.09 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.114 1.365 . . . . 0.0 114.682 -170.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -157.72 175.06 14.39 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.978 1.711 . . . . 0.0 111.418 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 -146.4 149.66 34.18 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.219 1.808 . . . . 0.0 110.507 172.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 88.0 mt -133.87 145.67 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.853 1.661 . . . . 0.0 109.605 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.2 pt20 -149.73 170.43 18.74 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.128 1.771 . . . . 0.0 110.36 169.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 25.4 p -72.08 164.51 26.03 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.536 -1.352 . . . . 0.0 112.191 173.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -55.34 -41.79 72.96 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.273 -0.892 . . . . 0.0 111.934 169.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -69.38 -38.13 77.89 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.859 0.864 . . . . 0.0 113.213 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -61.44 -41.31 97.0 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.841 0.856 . . . . 0.0 111.962 173.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 66.1 t80 . . . . . 0 CA--C 1.54 0.561 0 CA-C-N 118.383 0.538 . . . . 0.0 111.843 172.581 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 . . . . . 0 N--CA 1.48 1.043 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -60.34 -14.21 17.24 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.395 1.478 . . . . 0.0 114.524 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 46.3 p-80 -117.3 18.05 14.54 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 128.154 2.582 . . . . 0.0 112.44 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 26.6 t -123.92 143.75 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.239 1.416 . . . . 0.0 111.267 -174.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 70.8 mt -121.88 166.54 14.25 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.462 2.305 . . . . 0.0 110.672 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -125.21 142.82 51.27 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 126.641 1.977 . . . . 0.0 108.395 168.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -135.64 142.46 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.836 1.254 . . . . 0.0 109.558 -169.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 2.0 m -129.65 137.4 50.64 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.119 1.368 . . . . 0.0 109.796 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -159.36 157.3 27.01 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 124.413 1.085 . . . . 0.0 112.371 -169.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.52 143.85 65.65 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.721 2.947 . . . . 0.0 112.75 169.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -55.61 -25.38 38.38 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -65.95 -13.41 59.72 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.562 1.545 . . . . 0.0 114.356 177.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -69.14 156.37 38.8 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.321 1.048 . . . . 0.0 112.784 172.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -128.99 171.17 12.61 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.538 1.935 . . . . 0.0 110.969 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.0 m -52.41 -32.55 39.58 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.025 1.33 . . . . 0.0 111.757 169.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.3 m -64.46 -43.23 94.88 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 173.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -66.48 -30.99 71.44 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.572 -0.705 . . . . 0.0 111.277 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 74.9 mt -70.15 -43.77 70.19 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.639 0.776 . . . . 0.0 111.408 173.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -58.5 -39.91 81.35 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 120.854 -1.154 . . . . 0.0 112.196 169.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -65.83 -34.51 78.31 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 119.126 0.875 . . . . 0.0 113.038 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 58.3 tp -70.64 -31.03 67.83 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.595 1.158 . . . . 0.0 113.056 176.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -117.22 6.03 12.74 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -171.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 78.2 p -57.67 -25.29 60.02 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 178.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.16 -15.65 15.82 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.549 1.54 . . . . 0.0 114.662 176.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -101.8 3.07 39.04 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.108 1.363 . . . . 0.0 114.069 -176.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.89 -48.72 4.1 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.906 1.717 . . . . 0.0 114.998 169.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -152.13 140.18 20.2 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.805 1.242 . . . . 0.0 111.113 176.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 30.5 pt -146.0 174.94 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.925 1.69 . . . . 0.0 111.842 -171.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 8.0 tm0? -139.91 139.54 36.22 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.978 1.311 . . . . 0.0 108.612 169.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 72.5 mt -120.84 130.07 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.879 1.272 . . . . 0.0 109.448 -175.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.3 m -134.78 99.61 4.37 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.335 1.454 . . . . 0.0 111.335 -176.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -57.4 152.26 14.74 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.768 1.227 . . . . 0.0 113.666 175.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 19.6 pt -134.15 -25.86 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.77 1.228 . . . . 0.0 113.173 169.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -156.0 179.32 9.33 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.048 1.339 . . . . 0.0 112.114 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.88 -14.09 60.84 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 -175.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 50.1 p -132.46 6.44 4.11 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.295 1.438 . . . . 0.0 113.603 -177.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 1.1 p -150.92 152.15 33.2 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 173.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -155.34 159.45 39.95 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.372 1.469 . . . . 0.0 111.87 -174.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.87 152.48 21.23 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.426 0.69 . . . . 0.0 110.769 168.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 59.6 t -137.21 116.25 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.954 1.301 . . . . 0.0 109.748 174.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 8.4 t -85.08 140.85 30.67 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.961 1.304 . . . . 0.0 110.53 172.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 60.9 mt -117.77 165.05 14.1 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.235 1.414 . . . . 0.0 111.548 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 9.4 t -62.97 -32.38 73.7 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.399 1.08 . . . . 0.0 113.864 -173.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -152.67 157.34 33.44 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.193 0.997 . . . . 0.0 112.919 175.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.13 -33.24 63.1 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.393 3.395 . . . . 0.0 115.517 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -58.21 -35.65 71.96 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -70.0 -23.4 63.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.405 1.082 . . . . 0.0 113.262 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 99.0 t -59.48 -44.22 92.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.155 1.382 . . . . 0.0 111.094 177.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -66.57 -34.95 79.05 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.594 0.758 . . . . 0.0 112.061 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 59.8 mt -64.96 -48.15 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.696 0.798 . . . . 0.0 110.212 176.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.95 -38.51 91.34 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.3 t -63.97 -40.22 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 121.31 -0.869 . . . . 0.0 111.361 173.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -61.09 -49.92 75.34 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.03 0.832 . . . . 0.0 112.201 172.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.0 p -67.3 -27.01 66.82 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -174.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 9.4 t -64.27 -19.7 65.57 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 171.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -60.78 -18.82 57.42 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.519 1.128 . . . . 0.0 113.147 172.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -117.33 7.69 12.92 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.858 1.663 . . . . 0.0 112.762 -175.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.22 156.97 30.14 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.27 1.428 . . . . 0.0 113.392 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -134.23 -12.26 2.47 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.773 1.229 . . . . 0.0 114.058 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 38.3 m -139.13 6.89 2.4 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.08 1.352 . . . . 0.0 113.744 -173.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -158.65 176.01 12.92 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.042 1.737 . . . . 0.0 111.31 -176.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . 0.446 HH22 ' NE2' ' A' ' 500' ' ' GLN . 50.1 ttp85 -147.27 145.79 29.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.581 1.952 . . . . 0.0 110.098 174.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 69.5 mt -130.77 141.97 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.738 1.615 . . . . 0.0 109.629 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . 0.446 ' NE2' HH22 ' A' ' 498' ' ' ARG . 24.0 pt20 -145.1 166.59 24.96 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.825 1.65 . . . . 0.0 110.924 171.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 52.0 p -71.72 163.24 28.15 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 120.756 -1.215 . . . . 0.0 112.378 174.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -58.69 -37.01 75.13 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.187 -0.946 . . . . 0.0 112.063 170.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.71 95.95 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.333 -0.854 . . . . 0.0 112.809 174.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -65.35 -32.68 74.45 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.348 -0.845 . . . . 0.0 112.977 173.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 73.2 t80 . . . . . 0 CA--C 1.539 0.532 0 CA-C-N 119.119 0.872 . . . . 0.0 111.427 169.586 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 113.874 1.065 . . . . 0.0 113.874 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.64 -15.42 63.64 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.649 -1.282 . . . . 0.0 113.578 176.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 -88.19 8.0 29.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.401 1.881 . . . . 0.0 114.08 172.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 40.7 t -110.86 148.58 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.092 1.357 . . . . 0.0 110.903 -173.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 94.5 mt -122.69 164.24 18.63 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.186 2.594 . . . . 0.0 110.522 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -126.75 139.12 53.37 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.461 1.905 . . . . 0.0 107.679 168.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.4 t -132.85 141.83 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.975 1.31 . . . . 0.0 109.226 -169.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.6 m -132.88 135.15 45.42 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.881 1.272 . . . . 0.0 109.753 -177.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -159.85 162.55 24.51 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 124.994 1.318 . . . . 0.0 111.719 -168.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.44 149.14 90.55 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.215 1.943 . . . . 0.0 110.909 168.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -18.54 13.71 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -57.34 -26.26 60.69 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.052 1.741 . . . . 0.0 113.979 173.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 19.7 m95 -64.65 154.4 36.56 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.001 0.921 . . . . 0.0 113.087 175.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -132.17 164.99 25.1 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.597 1.959 . . . . 0.0 111.129 177.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.9 m -53.29 -34.75 58.61 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.743 1.217 . . . . 0.0 112.156 173.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.2 m -65.36 -43.35 91.11 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.734 1.012 . . . . 0.0 113.734 175.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -64.81 -31.64 72.96 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.675 -0.64 . . . . 0.0 111.309 174.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.2 mt -71.05 -44.99 64.66 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.031 0.932 . . . . 0.0 111.551 175.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -57.22 -42.54 81.57 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.009 -1.057 . . . . 0.0 112.109 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -68.26 -29.07 67.79 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.458 1.103 . . . . 0.0 113.935 177.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.6 tp -69.5 -36.49 76.52 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.334 1.054 . . . . 0.0 112.316 173.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -110.96 -2.61 15.92 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -170.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 79.0 p -58.09 -19.66 33.8 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 176.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -57.41 -18.93 20.36 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.084 1.354 . . . . 0.0 114.133 170.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -100.18 2.71 43.2 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.743 1.617 . . . . 0.0 113.612 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 96.27 -159.67 21.97 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.011 1.291 . . . . 0.0 111.891 -171.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -64.24 150.37 46.06 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 121.838 -0.801 . . . . 0.0 111.25 169.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 5.5 pt -143.53 179.76 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 125.338 1.455 . . . . 0.0 111.655 -174.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -128.15 151.9 48.66 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.537 1.535 . . . . 0.0 110.699 170.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 60.3 mt -139.4 134.35 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.919 1.688 . . . . 0.0 108.972 -172.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.9 m -139.35 102.2 4.43 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.991 1.316 . . . . 0.0 111.384 -177.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -59.28 153.15 19.28 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 29.5 pt -134.9 -23.93 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.831 1.252 . . . . 0.0 113.416 169.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -153.7 174.38 14.59 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.353 1.061 . . . . 0.0 111.947 174.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -60.88 -15.09 26.82 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.601 1.96 . . . . 0.0 113.898 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 37.2 p -135.91 6.24 3.14 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.001 2.12 . . . . 0.0 113.448 -174.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 66.5 m -147.38 140.29 25.0 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.394 1.078 . . . . 0.0 113.218 -174.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.45 158.7 42.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.529 1.131 . . . . 0.0 112.49 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -89.04 153.29 21.12 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.753 0.821 . . . . 0.0 110.006 167.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 73.4 t -136.3 140.53 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.92 1.288 . . . . 0.0 109.091 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 43.0 m -124.97 116.09 21.61 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.206 1.403 . . . . 0.0 110.083 -169.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 47.1 mt -102.94 166.32 10.52 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.202 1.401 . . . . 0.0 111.176 -175.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 50.8 m -69.84 -26.75 64.37 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 -175.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -148.22 148.85 30.54 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 124.497 1.119 . . . . 0.0 112.348 -177.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -57.18 -26.02 67.37 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 123.5 2.8 . . . . 0.0 114.124 168.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -61.04 -33.54 73.46 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.064 -1.023 . . . . 0.0 112.56 172.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -76.46 -34.31 58.7 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.845 0.858 . . . . 0.0 111.799 174.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 22.4 t -57.54 -44.69 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.065 0.946 . . . . 0.0 111.354 170.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -58.97 -41.04 86.58 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.133 0.573 . . . . 0.0 112.378 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 91.0 mt -66.87 -45.76 86.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.634 0.773 . . . . 0.0 110.938 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.1 -34.32 76.1 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 119.324 0.965 . . . . 0.0 113.466 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 60.4 t -65.73 -43.84 93.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 O-C-N 121.296 -0.878 . . . . 0.0 111.003 170.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -60.5 -45.06 95.16 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.922 0.783 . . . . 0.0 112.729 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 46.0 p -71.64 -27.4 63.06 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -177.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 24.8 p -63.21 -19.05 64.17 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 59.1 mtmt -60.96 -18.38 56.95 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.254 1.422 . . . . 0.0 113.963 173.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -119.06 1.4 11.41 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.064 1.345 . . . . 0.0 113.211 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -68.19 152.78 44.96 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.669 1.188 . . . . 0.0 112.469 173.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -132.27 -4.9 3.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.818 1.247 . . . . 0.0 114.044 -177.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 22.6 m -136.52 5.9 2.96 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.322 1.449 . . . . 0.0 113.413 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -161.04 171.52 18.47 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.039 2.135 . . . . 0.0 110.173 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -147.79 156.88 43.2 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.122 1.369 . . . . 0.0 111.06 169.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 69.3 mt -133.49 146.38 32.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.766 1.626 . . . . 0.0 109.572 -174.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -142.11 161.78 37.15 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.98 1.712 . . . . 0.0 109.679 168.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 26.3 p -71.89 162.29 29.67 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.702 -1.249 . . . . 0.0 111.888 173.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -60.39 -33.41 72.44 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.161 -0.962 . . . . 0.0 111.953 169.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.91 -38.02 89.58 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.299 -0.875 . . . . 0.0 113.111 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -67.78 -39.67 84.07 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.09 -1.006 . . . . 0.0 112.144 172.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 62.0 t80 . . . . . 0 CA--C 1.545 0.777 0 C-N-CA 124.247 1.019 . . . . 0.0 112.288 174.175 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.924 0 CA-C-O 121.563 0.697 . . . . 0.0 112.398 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -156.13 -43.07 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.816 2.046 . . . . 0.0 109.729 170.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 -70.26 38.19 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.132 2.973 . . . . 0.0 112.941 168.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 46.3 t -128.07 126.11 65.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 125.005 1.322 . . . . 0.0 111.027 -168.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 83.8 mt -92.68 168.31 11.31 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.423 1.889 . . . . 0.0 111.723 174.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 41.2 t-80 -128.19 136.23 50.81 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.43 2.292 . . . . 0.0 106.928 166.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 10.7 t -132.77 136.02 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.602 1.161 . . . . 0.0 109.091 -171.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 16.5 m -124.82 135.51 53.0 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.109 1.364 . . . . 0.0 109.689 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -156.2 156.51 30.39 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 124.487 1.115 . . . . 0.0 112.671 -169.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.22 150.96 30.54 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.813 3.009 . . . . 0.0 112.644 168.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -56.18 -22.19 27.49 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -62.09 -27.66 69.07 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.456 1.503 . . . . 0.0 113.512 176.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -68.54 150.2 48.32 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.118 0.967 . . . . 0.0 112.968 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 36.0 mttm -135.08 174.29 10.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.366 1.866 . . . . 0.0 112.145 176.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.4 m -48.36 -36.35 14.35 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.026 1.73 . . . . 0.0 112.713 173.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.8 m -64.63 -45.33 87.27 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 175.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -63.49 -30.93 71.98 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.369 0.668 . . . . 0.0 111.416 175.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 73.6 mt -71.02 -46.62 61.82 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.821 0.849 . . . . 0.0 111.639 175.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -61.95 -31.11 71.42 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.639 -1.288 . . . . 0.0 113.422 171.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -72.65 -34.65 67.41 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.442 1.097 . . . . 0.0 113.26 172.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 65.2 tp -64.5 -30.61 71.64 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.469 1.108 . . . . 0.0 112.253 172.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -115.64 22.95 12.72 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.95 1.3 . . . . 0.0 113.938 -175.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 92.1 p -59.12 -21.61 59.57 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.309 1.043 . . . . 0.0 113.796 172.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -61.73 -19.2 62.16 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.505 1.522 . . . . 0.0 114.047 169.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -115.05 -39.39 3.66 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.389 1.475 . . . . 0.0 111.483 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 65.36 7.98 35.49 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 125.707 1.622 . . . . 0.0 117.06 169.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -143.06 17.61 1.93 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.194 1.398 . . . . 0.0 112.886 -170.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 19.5 pt -64.83 171.37 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 125.636 1.574 . . . . 0.0 113.577 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -134.55 144.05 47.75 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.301 1.441 . . . . 0.0 109.16 169.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 86.4 mt -121.63 133.97 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.154 0.982 . . . . 0.0 109.943 -169.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 71.2 m -134.82 97.03 3.66 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.138 1.775 . . . . 0.0 109.938 -176.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -57.86 158.32 6.61 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 8.9 mt -132.89 -42.93 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.974 1.309 . . . . 0.0 109.537 177.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -155.16 -179.03 7.68 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.461 1.504 . . . . 0.0 111.85 173.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -59.61 -16.16 23.81 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.805 1.642 . . . . 0.0 114.831 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 67.6 p -132.23 3.0 3.95 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.052 1.741 . . . . 0.0 114.577 -173.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 3.6 p -151.8 153.99 35.34 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 170.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -150.83 155.03 38.37 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.924 1.29 . . . . 0.0 112.353 -177.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -89.5 148.11 23.6 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.045 0.938 . . . . 0.0 109.517 167.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 56.4 t -138.61 111.24 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.956 0.902 . . . . 0.0 110.652 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 74.0 m -77.42 139.43 39.68 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.333 1.453 . . . . 0.0 111.44 174.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 52.1 mt -110.82 170.8 7.86 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.424 1.49 . . . . 0.0 111.625 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 61.9 m -77.97 -26.04 48.48 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -144.93 148.74 40.04 Favored Pre-proline 0 CA--C 1.544 0.734 0 C-N-CA 125.144 1.378 . . . . 0.0 111.207 178.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -55.1 -29.56 66.29 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.682 2.921 . . . . 0.0 114.551 171.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -59.89 -36.16 76.37 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.524 1.13 . . . . 0.0 113.1 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -67.28 -20.9 65.71 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.458 1.103 . . . . 0.0 113.252 -178.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 96.9 t -60.42 -44.43 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.241 1.016 . . . . 0.0 111.01 176.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -68.03 -35.42 78.24 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.721 0.808 . . . . 0.0 111.497 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 68.2 mt -61.79 -48.29 89.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.813 0.845 . . . . 0.0 110.453 176.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.8 82.31 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 72.0 t -65.9 -41.43 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 O-C-N 121.134 -0.979 . . . . 0.0 111.209 171.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -62.43 -32.31 73.14 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.148 0.979 . . . . 0.0 113.271 176.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 39.4 p -86.24 -27.52 24.4 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.019 0.928 . . . . 0.0 113.086 178.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 11.2 t -69.58 -24.05 63.63 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -60.67 -19.31 58.11 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -90.16 -10.34 44.89 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.305 1.442 . . . . 0.0 114.066 176.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -68.92 152.53 45.16 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.204 1.002 . . . . 0.0 113.535 -173.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -140.61 2.93 1.85 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.222 1.409 . . . . 0.0 113.864 175.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 77.4 p -135.84 1.07 2.74 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.271 1.828 . . . . 0.0 113.742 -177.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -156.34 175.04 14.53 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.425 2.29 . . . . 0.0 109.591 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 46.3 ttm180 -147.04 146.84 30.15 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.031 1.332 . . . . 0.0 110.984 175.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 48.3 mt -129.27 139.48 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.972 1.709 . . . . 0.0 109.055 175.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -147.57 171.27 15.84 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.449 1.9 . . . . 0.0 109.829 173.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 19.0 p -72.86 164.01 27.26 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 120.334 -1.479 . . . . 0.0 112.319 172.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -52.85 -44.6 66.88 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.523 0.729 . . . . 0.0 111.518 168.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -69.14 -35.25 76.17 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -63.58 -43.72 96.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.168 0.895 . . . . 0.0 111.965 173.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 75.9 t80 . . . . . 0 CA--C 1.537 0.471 0 C-N-CA 123.005 0.522 . . . . 0.0 111.773 174.208 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -60.37 -25.96 66.27 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 120.801 -1.187 . . . . 0.0 113.791 178.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -92.82 18.94 8.17 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.484 1.914 . . . . 0.0 113.737 176.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 24.6 t -125.85 147.44 30.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.773 1.229 . . . . 0.0 111.98 -169.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 74.3 mt -118.45 164.08 15.79 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.568 2.347 . . . . 0.0 110.849 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -122.87 139.2 54.28 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 126.783 2.033 . . . . 0.0 107.772 168.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.0 t -131.34 142.11 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.855 1.262 . . . . 0.0 109.345 -169.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.54 136.16 50.38 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.458 1.503 . . . . 0.0 109.581 -178.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -160.08 157.88 25.69 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 123.598 0.759 . . . . 0.0 112.963 -170.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.65 145.75 68.86 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.757 2.971 . . . . 0.0 112.499 168.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -55.69 -24.59 35.27 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 -176.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -67.1 -17.63 64.96 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.985 1.314 . . . . 0.0 114.162 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -62.63 155.08 27.16 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.094 0.958 . . . . 0.0 112.979 173.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -139.53 165.79 26.29 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.528 1.931 . . . . 0.0 110.674 -173.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.7 m -57.03 -32.48 66.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.115 0.966 . . . . 0.0 111.763 176.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 43.6 m -66.58 -42.03 87.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 173.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -65.79 -31.71 72.83 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.438 -0.789 . . . . 0.0 111.248 174.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.4 mt -70.68 -44.92 66.0 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.861 0.864 . . . . 0.0 111.501 174.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -57.51 -38.2 74.26 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.091 -1.006 . . . . 0.0 112.407 169.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -68.29 -40.36 81.8 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.98 0.809 . . . . 0.0 112.999 175.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.0 tp -64.32 -36.02 82.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.842 1.257 . . . . 0.0 112.273 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -106.84 10.42 30.68 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.569 1.148 . . . . 0.0 113.419 -176.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 22.2 t -55.81 -31.74 62.93 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.664 1.586 . . . . 0.0 113.791 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.84 -15.23 11.5 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.443 1.497 . . . . 0.0 115.021 178.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -101.63 -0.52 34.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.888 1.275 . . . . 0.0 114.11 -176.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 77.31 -41.73 1.85 Allowed Glycine 0 CA--C 1.536 1.399 0 C-N-CA 126.086 1.803 . . . . 0.0 116.101 169.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -148.59 130.81 15.5 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.282 1.433 . . . . 0.0 110.673 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 18.7 pt -145.92 174.73 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.435 1.494 . . . . 0.0 111.478 -172.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.88 146.82 41.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.813 1.245 . . . . 0.0 109.001 168.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 67.9 mt -127.78 130.07 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.032 1.333 . . . . 0.0 109.222 -174.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 51.8 m -136.85 94.74 3.01 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.195 1.398 . . . . 0.0 111.022 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -55.83 154.33 7.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.701 1.2 . . . . 0.0 113.633 176.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 17.7 pt -132.27 -28.97 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.474 1.109 . . . . 0.0 113.617 170.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -160.15 -175.16 4.91 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.917 1.287 . . . . 0.0 112.44 172.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -57.89 -22.0 46.17 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 -177.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.6 p -134.2 5.33 3.53 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.938 1.295 . . . . 0.0 113.979 -171.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 60.9 m -143.56 147.92 35.16 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.705 1.202 . . . . 0.0 113.295 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.26 156.23 39.29 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.299 1.44 . . . . 0.0 111.753 175.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -89.9 151.57 21.67 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.557 0.743 . . . . 0.0 110.18 168.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.5 t -137.98 115.9 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.496 1.118 . . . . 0.0 110.325 176.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 16.3 m -83.62 140.64 32.08 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.074 1.35 . . . . 0.0 110.673 172.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 80.4 mt -123.18 147.04 47.28 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.769 1.227 . . . . 0.0 110.2 176.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 5.2 m -65.8 -16.01 63.41 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 115.767 1.766 . . . . 0.0 115.767 -172.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -140.25 148.09 52.75 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 124.562 1.145 . . . . 0.0 111.429 175.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -70.0 -20.75 33.29 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.105 2.537 . . . . 0.0 113.579 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -66.59 -32.61 74.06 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.825 -1.172 . . . . 0.0 112.346 172.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -67.29 -31.2 71.35 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.163 0.985 . . . . 0.0 112.189 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.2 t -58.64 -46.42 90.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.242 1.417 . . . . 0.0 110.741 173.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -63.86 -41.92 97.66 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.501 0.72 . . . . 0.0 112.031 176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 94.6 mt -63.1 -42.55 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.579 0.752 . . . . 0.0 111.292 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.41 -39.72 95.26 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.114 -0.991 . . . . 0.0 113.094 176.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 69.2 t -66.16 -42.02 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 O-C-N 121.218 -0.926 . . . . 0.0 111.347 172.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -61.22 -37.66 83.84 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.121 0.968 . . . . 0.0 113.116 176.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 22.0 p -83.32 -28.87 28.74 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.556 1.142 . . . . 0.0 113.237 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 8.7 t -60.78 -19.38 59.23 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 171.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -51.77 -26.54 9.84 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.703 1.601 . . . . 0.0 113.661 169.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -114.9 10.15 16.31 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.606 1.562 . . . . 0.0 113.093 -174.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -64.71 156.56 29.97 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.931 1.293 . . . . 0.0 113.095 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.55 -5.46 1.21 Allowed 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 176.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 51.0 m -137.31 5.08 2.71 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.392 1.477 . . . . 0.0 113.629 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 49.5 p90 -157.92 176.07 13.02 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.241 1.816 . . . . 0.0 111.208 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 69.5 ttt-85 -147.34 145.21 29.24 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.003 2.121 . . . . 0.0 109.997 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 79.2 mt -132.5 141.61 44.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.434 1.494 . . . . 0.0 109.841 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -143.12 163.82 31.81 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.109 1.764 . . . . 0.0 110.509 169.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 65.1 p -73.02 161.51 30.59 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.753 -1.217 . . . . 0.0 112.347 174.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -60.42 -34.15 73.54 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.206 -0.934 . . . . 0.0 111.591 168.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -63.88 -37.82 88.81 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.447 -0.783 . . . . 0.0 113.09 174.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -66.52 -42.36 87.41 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.13 -0.982 . . . . 0.0 112.168 170.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 57.1 t80 . . . . . 0 CA--C 1.541 0.622 0 CA-C-N 118.777 0.717 . . . . 0.0 111.422 173.648 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 . . . . . 0 N--CA 1.485 1.308 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -63.35 -22.8 67.1 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 121.087 -1.008 . . . . 0.0 113.543 176.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -90.32 15.36 10.66 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.757 2.023 . . . . 0.0 113.93 175.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 42.5 t -117.59 141.78 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.929 1.292 . . . . 0.0 111.182 -173.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 93.7 mt -108.16 163.58 13.05 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 126.819 2.048 . . . . 0.0 111.489 176.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -122.53 136.19 54.83 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.699 2.0 . . . . 0.0 107.026 166.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 4.8 t -132.27 138.59 52.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 124.893 1.277 . . . . 0.0 109.088 -169.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.2 m -129.55 136.17 49.49 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.924 1.29 . . . . 0.0 109.529 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -158.85 155.96 25.8 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.404 1.082 . . . . 0.0 112.538 -169.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.13 144.85 78.86 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.5 2.8 . . . . 0.0 111.418 167.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 7.2 ptpt -59.59 -19.14 46.72 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -176.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.43 -21.77 66.49 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.696 1.598 . . . . 0.0 114.016 172.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -63.36 150.94 42.21 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.002 0.819 . . . . 0.0 112.276 172.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -130.73 169.1 16.14 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.329 1.852 . . . . 0.0 111.634 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.5 m -50.92 -34.46 28.63 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.652 1.181 . . . . 0.0 112.513 171.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 43.2 m -66.19 -40.18 90.24 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -66.82 -31.97 72.93 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.608 -0.683 . . . . 0.0 111.168 173.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 90.8 mt -70.56 -41.38 72.52 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.615 0.766 . . . . 0.0 111.485 174.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -60.55 -42.22 96.12 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.959 -1.088 . . . . 0.0 111.634 169.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.3 tt0 -60.78 -33.91 73.68 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.122 -0.986 . . . . 0.0 112.681 175.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 44.9 tp -79.49 -27.23 41.48 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.849 1.26 . . . . 0.0 114.105 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -128.76 -17.5 4.02 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 116.888 2.181 . . . . 0.0 116.888 -168.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 14.8 t -60.87 -21.8 63.63 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.63 1.559 . . . . 0.0 113.43 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -54.36 -24.32 19.01 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.413 1.485 . . . . 0.0 114.521 171.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -80.46 -1.23 40.75 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 99.77 -44.67 1.61 Allowed Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.705 1.622 . . . . 0.0 114.541 168.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -152.69 136.91 16.54 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.12 1.368 . . . . 0.0 110.391 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 29.1 pt -144.42 171.79 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.679 1.191 . . . . 0.0 112.298 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -143.89 145.82 32.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.133 1.373 . . . . 0.0 109.146 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 77.0 mt -127.15 128.71 70.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.752 1.221 . . . . 0.0 109.158 -172.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 46.3 m -136.18 99.38 4.11 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.455 1.502 . . . . 0.0 111.071 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -58.42 151.1 20.74 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.196 0.998 . . . . 0.0 113.63 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 38.2 pt -133.59 -19.84 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.778 1.231 . . . . 0.0 113.278 169.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -152.0 178.19 9.69 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.743 1.217 . . . . 0.0 111.713 172.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -66.17 -14.66 62.21 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.158 1.783 . . . . 0.0 112.926 174.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.0 p -134.64 5.03 3.39 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.598 1.959 . . . . 0.0 113.718 -172.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 88.0 p -155.05 154.9 33.16 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.39 161.5 42.25 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.663 1.585 . . . . 0.0 112.088 -177.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -93.48 149.66 21.06 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.982 0.913 . . . . 0.0 110.054 167.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.2 t -138.3 114.91 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.174 0.99 . . . . 0.0 110.746 177.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 19.3 m -77.61 141.21 39.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.835 1.254 . . . . 0.0 111.066 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 70.7 mt -121.08 165.62 15.07 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.42 1.488 . . . . 0.0 110.621 171.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 55.0 m -63.67 -29.66 70.86 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -146.47 152.4 45.71 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.628 1.171 . . . . 0.0 112.385 -176.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.37 -17.23 39.45 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.329 2.686 . . . . 0.0 113.497 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -63.23 -35.61 80.9 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.616 -1.303 . . . . 0.0 111.539 169.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -74.96 -30.57 61.25 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.125 0.97 . . . . 0.0 112.356 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 13.5 t -57.02 -44.96 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.008 0.923 . . . . 0.0 111.173 171.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -60.81 -41.27 95.34 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.107 0.563 . . . . 0.0 112.272 176.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 98.8 mt -61.43 -50.64 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.806 0.842 . . . . 0.0 110.668 176.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.87 -36.54 83.64 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 78.3 t -65.75 -41.16 89.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 121.117 -0.989 . . . . 0.0 111.242 171.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -63.2 -43.84 97.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.795 0.725 . . . . 0.0 112.832 176.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 35.3 p -68.86 -27.82 66.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.708 0.803 . . . . 0.0 113.068 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.3 t -65.53 -18.24 65.18 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 174.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -60.29 -14.32 17.52 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.702 1.201 . . . . 0.0 114.043 176.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -128.95 13.29 6.27 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.076 1.75 . . . . 0.0 112.609 -176.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.05 159.21 23.69 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.997 1.319 . . . . 0.0 113.044 175.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -138.06 -0.99 2.01 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -178.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 8.7 t -145.03 4.74 1.1 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.218 1.407 . . . . 0.0 113.006 -178.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -159.27 174.85 14.16 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.378 1.471 . . . . 0.0 111.637 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 79.2 ttt-85 -145.01 147.82 33.05 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.386 1.874 . . . . 0.0 110.313 169.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 68.4 mt -129.1 141.45 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.336 1.855 . . . . 0.0 109.611 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -144.52 166.07 26.2 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.932 1.693 . . . . 0.0 109.728 169.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 25.7 p -71.79 162.28 29.68 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.696 -1.252 . . . . 0.0 111.677 175.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -57.09 -39.19 74.52 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.278 -0.889 . . . . 0.0 111.829 168.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.76 -36.97 86.02 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -67.33 -40.96 85.95 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.171 -0.956 . . . . 0.0 112.145 173.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 71.3 t80 . . . . . 0 CA--C 1.54 0.584 0 CA-C-N 118.42 0.555 . . . . 0.0 111.476 172.605 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 73.4 mtt180 . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 116.077 1.881 . . . . 0.0 116.077 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.29 -15.57 57.64 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 -96.27 13.79 26.36 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.909 2.084 . . . . 0.0 113.695 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 55.4 t -128.0 143.5 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.915 1.286 . . . . 0.0 111.777 -171.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 72.1 mt -107.16 166.3 10.73 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 127.342 2.257 . . . . 0.0 111.496 175.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 22.8 t-80 -121.53 137.55 54.68 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.974 2.11 . . . . 0.0 107.103 166.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 13.4 t -133.81 139.72 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.877 1.271 . . . . 0.0 108.958 -169.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.0 m -128.72 132.52 47.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.193 1.397 . . . . 0.0 109.252 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -151.49 159.71 32.93 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.444 1.098 . . . . 0.0 112.895 -168.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -52.15 150.15 19.96 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.19 3.26 . . . . 0.0 114.058 170.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.0 pttm -53.67 -28.05 31.1 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.456 1.503 . . . . 0.0 115.048 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -81.55 -12.91 58.63 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.406 1.483 . . . . 0.0 114.212 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 7.6 m0 -65.63 152.8 43.31 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.305 0.957 . . . . 0.0 112.982 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -129.72 168.93 15.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.403 1.881 . . . . 0.0 111.832 -178.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.2 m -48.53 -35.45 13.29 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.444 1.498 . . . . 0.0 112.213 169.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 70.8 m -64.41 -43.72 93.5 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -64.54 -33.18 75.32 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.751 -0.593 . . . . 0.0 111.147 174.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.92 -44.57 65.91 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.87 0.868 . . . . 0.0 111.792 176.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.38 -43.42 92.91 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.166 -0.959 . . . . 0.0 112.018 169.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -61.43 -32.21 72.17 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.923 0.783 . . . . 0.0 112.977 175.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 52.7 tp -74.83 -34.3 62.31 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.499 1.12 . . . . 0.0 113.254 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -116.53 -5.88 11.69 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -169.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 87.1 p -57.62 -22.88 48.0 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 114.549 1.315 . . . . 0.0 114.549 175.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.4 -21.62 51.21 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.063 1.345 . . . . 0.0 114.17 173.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -94.24 -5.89 45.86 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.157 1.383 . . . . 0.0 113.779 177.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 109.69 -154.07 16.68 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 125.071 1.319 . . . . 0.0 112.213 -173.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -61.37 153.61 26.34 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.652 0.781 . . . . 0.0 112.13 169.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 33.0 pt -142.54 176.92 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 125.389 1.476 . . . . 0.0 111.795 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -143.82 146.16 32.87 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.2 1.4 . . . . 0.0 108.926 169.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 77.8 mt -129.48 133.28 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.679 1.192 . . . . 0.0 109.289 -172.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 39.5 m -134.78 97.38 3.76 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.742 1.617 . . . . 0.0 110.497 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -60.01 153.29 21.79 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.731 1.212 . . . . 0.0 113.955 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 28.9 pt -133.44 -24.47 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.817 1.247 . . . . 0.0 112.9 169.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -149.75 173.18 14.0 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.748 1.619 . . . . 0.0 112.064 173.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.81 -20.48 50.6 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.557 1.543 . . . . 0.0 113.66 169.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.4 p -126.58 0.93 6.86 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.046 1.738 . . . . 0.0 114.197 -172.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 36.3 p -154.4 151.26 28.8 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 174.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.87 160.58 43.08 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.617 1.567 . . . . 0.0 111.96 -176.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -89.13 149.76 23.02 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.448 0.699 . . . . 0.0 110.341 167.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 48.5 t -138.53 119.15 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 124.564 1.146 . . . . 0.0 110.773 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 14.1 t -80.99 144.52 31.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.191 1.396 . . . . 0.0 111.881 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 86.0 mt -129.66 155.6 45.61 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.737 1.615 . . . . 0.0 110.871 174.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 48.9 m -68.85 -24.17 64.33 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -169.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -137.99 151.45 70.12 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.75 1.22 . . . . 0.0 111.527 172.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -67.97 -18.63 46.42 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.262 2.641 . . . . 0.0 113.744 174.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.17 -37.93 89.24 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.662 -1.274 . . . . 0.0 111.98 170.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.3 -32.94 74.26 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.405 -0.81 . . . . 0.0 112.092 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.8 t -58.93 -47.28 90.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.79 1.236 . . . . 0.0 110.506 172.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -62.48 -42.87 99.79 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.571 -0.706 . . . . 0.0 112.211 176.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 87.4 mt -62.76 -43.81 99.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 123.76 0.824 . . . . 0.0 111.368 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.1 -38.56 91.68 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.324 -0.86 . . . . 0.0 113.069 177.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 71.1 t -66.76 -42.47 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 121.283 -0.886 . . . . 0.0 111.364 173.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -60.79 -44.44 96.8 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.032 0.833 . . . . 0.0 112.661 176.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 26.1 p -74.69 -21.74 59.23 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.224 1.009 . . . . 0.0 113.649 -178.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 21.2 p -65.2 -15.17 62.17 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 175.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -56.41 -15.14 3.64 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.671 1.588 . . . . 0.0 114.122 172.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -126.93 16.04 7.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.286 1.834 . . . . 0.0 112.333 -174.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.51 -36.75 84.77 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -174.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 52.68 -18.65 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 129.751 3.22 . . . . 0.0 118.906 -175.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 50.2 m -135.48 1.36 2.86 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.226 1.411 . . . . 0.0 114.371 -173.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -155.58 176.14 12.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.183 2.193 . . . . 0.0 109.56 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -144.6 150.26 37.15 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.289 1.036 . . . . 0.0 111.767 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 78.2 mt -135.66 144.11 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 126.083 1.753 . . . . 0.0 109.5 -177.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -147.54 168.63 21.47 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.148 1.779 . . . . 0.0 110.376 169.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 18.6 p -71.65 163.59 27.48 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 120.659 -1.276 . . . . 0.0 111.702 172.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -55.35 -42.06 73.35 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.272 -0.892 . . . . 0.0 112.308 169.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.25 92.94 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.653 0.781 . . . . 0.0 112.868 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.45 -31.9 72.4 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.442 -0.786 . . . . 0.0 112.66 175.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 39.4 t80 . . . . . 0 CA--C 1.54 0.586 0 CA-C-N 119.063 0.847 . . . . 0.0 111.415 169.016 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -66.91 -17.01 64.7 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.246 1.419 . . . . 0.0 113.234 169.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -95.2 14.67 21.42 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.899 2.08 . . . . 0.0 113.386 175.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 39.8 t -122.19 142.9 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 124.856 1.263 . . . . 0.0 111.583 -170.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 76.5 mt -114.12 164.35 13.97 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 127.328 2.251 . . . . 0.0 110.868 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -120.95 140.24 52.14 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.875 2.07 . . . . 0.0 107.772 168.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.5 t -133.62 142.79 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 C-N-CA 124.776 1.23 . . . . 0.0 109.15 -169.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 12.2 m -132.27 134.05 44.82 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.215 1.406 . . . . 0.0 109.581 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -158.55 157.32 28.6 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.293 1.037 . . . . 0.0 112.561 -169.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.83 144.17 78.24 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 123.53 2.82 . . . . 0.0 112.179 168.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -55.2 -24.27 26.3 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.44 -13.96 54.32 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.247 1.419 . . . . 0.0 114.554 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -68.99 156.0 39.37 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.5 1.12 . . . . 0.0 112.877 172.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -129.16 170.11 13.95 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.381 1.872 . . . . 0.0 111.058 174.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.1 m -51.81 -33.53 36.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.788 1.235 . . . . 0.0 111.943 169.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.3 m -64.83 -42.3 95.07 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 175.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -66.31 -31.8 72.81 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.626 -0.671 . . . . 0.0 111.094 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.2 mt -70.98 -43.02 68.92 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.78 0.832 . . . . 0.0 111.395 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -57.47 -44.1 84.6 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.926 -1.109 . . . . 0.0 111.511 169.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -62.45 -33.51 74.96 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 50.7 tp -73.93 -29.72 62.18 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.444 1.098 . . . . 0.0 113.412 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -120.38 -4.39 9.9 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.947 1.832 . . . . 0.0 115.947 -169.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 86.5 p -59.42 -20.24 53.46 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 173.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -60.77 -9.19 3.68 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.923 1.689 . . . . 0.0 114.87 172.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -119.28 14.97 13.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.745 1.618 . . . . 0.0 113.398 -172.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 89.31 -149.41 20.67 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.484 1.04 . . . . 0.0 112.704 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -62.58 142.55 57.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.482 0.713 . . . . 0.0 111.281 170.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 38.5 pt -142.57 174.16 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.489 1.515 . . . . 0.0 111.698 -176.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -138.79 142.37 38.74 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.897 1.279 . . . . 0.0 109.044 168.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 69.8 mt -122.33 124.89 71.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 125.067 1.347 . . . . 0.0 108.471 -176.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 75.7 m -135.25 94.83 3.18 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.416 1.486 . . . . 0.0 110.904 -169.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 86.7 m95 -56.27 152.72 10.6 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.325 1.05 . . . . 0.0 113.648 178.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 27.4 pt -129.88 -22.59 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 124.707 1.203 . . . . 0.0 113.206 170.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.43 -174.12 3.88 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.713 2.005 . . . . 0.0 110.233 169.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -74.08 -5.32 40.91 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -176.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 69.5 p -135.44 2.15 2.95 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 119.757 1.162 . . . . 0.0 114.064 -177.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 45.5 m -144.51 150.57 37.79 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.411 1.485 . . . . 0.0 113.295 173.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.6 156.89 41.37 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.195 1.398 . . . . 0.0 111.588 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -89.87 151.1 21.92 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.492 0.717 . . . . 0.0 109.874 167.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 63.1 t -138.34 114.53 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 124.137 0.975 . . . . 0.0 110.536 176.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 32.5 m -79.32 138.93 37.9 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.687 1.195 . . . . 0.0 110.533 171.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 56.1 mt -113.81 164.49 13.67 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.526 1.13 . . . . 0.0 111.703 175.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 22.7 t -55.49 -40.96 72.37 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.478 1.111 . . . . 0.0 113.452 -175.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -146.51 160.86 40.48 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.324 1.85 . . . . 0.0 110.982 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.88 -12.45 30.79 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.334 2.689 . . . . 0.0 114.074 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -61.53 -38.91 89.15 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.983 -1.073 . . . . 0.0 112.445 173.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -76.54 -20.4 56.91 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.069 0.948 . . . . 0.0 113.309 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.42 -44.58 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 124.653 1.181 . . . . 0.0 110.59 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -61.91 -40.47 95.58 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.698 0.799 . . . . 0.0 112.183 174.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 57.0 mt -65.12 -45.7 93.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.482 0.713 . . . . 0.0 110.843 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.5 -36.0 82.33 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 177.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 79.0 t -65.52 -40.93 89.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 120.987 -1.07 . . . . 0.0 110.992 170.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -63.13 -39.96 96.19 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.847 0.859 . . . . 0.0 113.156 176.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 44.2 p -76.68 -31.05 57.01 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.798 0.839 . . . . 0.0 112.842 -178.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.2 t -61.17 -19.58 61.74 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 173.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -54.16 -22.63 11.75 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.539 1.535 . . . . 0.0 113.54 169.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -122.73 10.38 9.63 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.903 1.681 . . . . 0.0 113.144 -175.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -66.45 157.33 32.29 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.513 1.125 . . . . 0.0 112.83 175.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.43 -5.1 1.24 Allowed 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 50.6 m -135.55 4.47 3.11 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.347 1.459 . . . . 0.0 113.468 -178.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.9 p90 -161.59 175.18 12.35 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.096 2.158 . . . . 0.0 110.213 -177.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 54.9 ttt85 -147.44 151.75 36.95 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.442 1.497 . . . . 0.0 111.17 169.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 49.3 mt -132.46 142.29 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 126.019 1.727 . . . . 0.0 110.091 -175.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.7 pt20 -145.34 171.43 14.61 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.304 1.841 . . . . 0.0 110.137 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 44.7 p -72.18 160.85 31.75 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 120.481 -1.387 . . . . 0.0 112.325 174.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -55.29 -43.01 74.37 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.5 -0.75 . . . . 0.0 111.565 168.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.75 -38.05 89.68 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.888 0.875 . . . . 0.0 113.31 179.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.04 -45.54 93.12 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.424 -0.798 . . . . 0.0 112.072 173.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 89.2 t80 . . . . . 0 CA--C 1.538 0.511 0 CA-C-N 118.51 0.595 . . . . 0.0 111.817 174.977 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 86.9 mmt-85 . . . . . 0 N--CA 1.488 1.425 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -67.35 -2.72 6.56 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 177.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 37.2 p-80 -117.3 12.86 14.45 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.322 1.849 . . . . 0.0 113.06 175.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 45.2 t -116.43 125.81 73.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.635 1.174 . . . . 0.0 111.849 -169.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.72 167.97 11.31 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.91 1.684 . . . . 0.0 111.693 169.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -128.13 136.68 51.48 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 127.052 2.141 . . . . 0.0 106.806 166.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 11.6 t -132.98 136.86 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.606 1.163 . . . . 0.0 109.131 -169.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 19.0 m -125.89 134.1 51.7 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.055 1.342 . . . . 0.0 109.423 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.9 p90 -156.78 156.98 30.58 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 124.362 1.065 . . . . 0.0 112.462 -168.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.24 145.22 67.18 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.548 2.832 . . . . 0.0 112.193 168.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -55.71 -22.96 26.17 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.362 1.615 . . . . 0.0 115.362 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.71 -12.86 61.42 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.398 1.479 . . . . 0.0 114.329 177.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -70.34 156.31 39.48 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.371 1.068 . . . . 0.0 113.115 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -131.82 170.23 15.13 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.387 1.875 . . . . 0.0 111.727 174.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.3 m -48.17 -37.84 16.63 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.199 1.8 . . . . 0.0 111.857 169.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.7 m -62.31 -45.25 94.07 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -64.56 -30.7 71.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.264 0.626 . . . . 0.0 111.529 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 77.1 mt -72.82 -46.45 53.05 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.853 0.861 . . . . 0.0 111.867 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -61.82 -31.9 72.17 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.774 -1.204 . . . . 0.0 112.809 170.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -69.9 -35.82 74.92 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.095 0.862 . . . . 0.0 112.787 172.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.1 -32.74 74.6 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.754 1.222 . . . . 0.0 112.251 175.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -114.02 13.41 18.19 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 -174.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 90.6 p -56.91 -26.37 59.01 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 178.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.48 -21.96 60.87 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.312 1.445 . . . . 0.0 114.466 174.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -92.98 -2.44 55.75 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.785 1.234 . . . . 0.0 113.703 177.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 78.84 -45.21 2.68 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 125.911 1.72 . . . . 0.0 114.248 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -145.54 151.31 37.94 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.649 1.58 . . . . 0.0 111.416 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 19.9 pt -149.36 178.94 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 127.28 2.232 . . . . 0.0 110.258 173.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -141.96 144.61 33.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.152 1.381 . . . . 0.0 109.007 167.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 66.0 mt -123.79 137.55 56.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.897 0.879 . . . . 0.0 110.585 -169.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 69.5 m -135.17 95.28 3.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.184 1.794 . . . . 0.0 109.932 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -58.86 152.25 19.74 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.996 0.919 . . . . 0.0 113.233 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 39.2 pt -134.74 -20.94 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.679 1.192 . . . . 0.0 113.524 172.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -153.32 175.6 12.92 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.649 1.179 . . . . 0.0 111.686 173.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -64.8 -13.34 55.21 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.803 1.641 . . . . 0.0 113.569 174.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 42.0 p -133.97 3.16 3.44 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.684 1.594 . . . . 0.0 113.928 -174.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 51.8 p -154.86 157.24 37.54 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 171.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.29 157.2 39.77 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.542 1.537 . . . . 0.0 111.831 -175.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -89.83 149.26 22.75 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.457 0.703 . . . . 0.0 110.176 167.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 42.6 t -138.17 111.12 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 124.135 0.974 . . . . 0.0 110.57 -179.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 58.5 m -75.81 139.05 41.56 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.355 1.462 . . . . 0.0 111.059 171.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 45.7 mt -113.15 159.7 18.99 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.178 1.391 . . . . 0.0 111.436 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 68.3 m -67.17 -26.38 66.61 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -143.09 147.11 39.68 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 124.876 1.271 . . . . 0.0 111.889 176.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.1 -33.13 82.64 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 123.896 3.064 . . . . 0.0 114.716 173.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.9 -29.5 70.25 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.178 -0.951 . . . . 0.0 113.175 178.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.69 -24.68 64.53 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.155 0.982 . . . . 0.0 112.51 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 66.4 t -62.37 -43.24 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.233 1.013 . . . . 0.0 110.539 175.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -63.44 -39.51 94.66 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.654 0.782 . . . . 0.0 111.894 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 82.6 mt -63.79 -47.39 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.913 0.885 . . . . 0.0 110.645 176.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.24 -39.86 94.81 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.62 -43.08 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.466 0.706 . . . . 0.0 111.324 173.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -62.98 -46.76 86.16 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.022 0.828 . . . . 0.0 112.678 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 29.9 p -74.33 -20.3 60.15 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -175.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 25.5 p -57.8 -24.81 59.06 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 173.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -56.49 -20.45 20.26 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.694 1.998 . . . . 0.0 114.016 174.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -109.36 4.79 22.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.312 1.445 . . . . 0.0 113.689 -174.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -64.9 159.69 22.2 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.03 0.932 . . . . 0.0 113.136 176.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -138.43 -2.46 1.79 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.009 1.324 . . . . 0.0 114.051 174.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 76.1 p -148.64 5.95 0.71 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.172 1.389 . . . . 0.0 114.364 -172.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -158.99 173.25 16.79 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.479 1.912 . . . . 0.0 110.741 -178.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -140.83 154.98 46.45 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.171 1.788 . . . . 0.0 110.982 169.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 62.0 mt -135.93 142.68 38.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.952 1.701 . . . . 0.0 109.058 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -149.96 173.68 13.54 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.222 1.809 . . . . 0.0 110.661 172.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 37.6 p -74.65 163.36 27.81 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 120.713 -1.242 . . . . 0.0 112.248 172.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -55.86 -42.02 75.25 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.285 -0.885 . . . . 0.0 112.053 169.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.63 91.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.113 0.965 . . . . 0.0 113.27 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -62.79 -43.67 98.18 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.437 -0.789 . . . . 0.0 112.133 172.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 87.4 t80 . . . . . 0 CA--C 1.538 0.507 0 CA-C-N 118.699 0.681 . . . . 0.0 111.985 175.32 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 . . . . . 0 N--CA 1.485 1.278 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -61.49 -15.44 37.82 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.137 1.375 . . . . 0.0 114.346 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -106.42 14.91 26.67 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.263 2.225 . . . . 0.0 113.236 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 30.4 t -120.89 143.97 31.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.824 1.249 . . . . 0.0 111.008 -176.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 88.9 mt -117.0 164.52 14.59 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.122 2.169 . . . . 0.0 111.124 177.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -123.04 139.31 54.2 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.734 2.014 . . . . 0.0 107.523 167.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.31 140.95 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 124.723 1.209 . . . . 0.0 109.792 -169.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 5.0 m -132.54 133.75 44.12 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.119 1.368 . . . . 0.0 109.735 -177.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -158.98 157.86 28.51 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 124.156 0.982 . . . . 0.0 112.332 -169.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.49 146.28 43.06 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.876 3.051 . . . . 0.0 113.465 170.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -53.86 -25.2 18.63 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -62.53 -18.9 62.97 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.211 1.804 . . . . 0.0 114.381 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 17.2 m95 -69.42 157.02 37.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.568 1.147 . . . . 0.0 112.961 176.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -129.38 167.52 17.64 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.16 1.784 . . . . 0.0 111.123 173.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.2 m -51.98 -33.08 36.35 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.113 1.365 . . . . 0.0 111.901 170.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 70.3 m -64.26 -43.3 95.29 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 174.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -66.45 -31.5 72.29 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.536 -0.728 . . . . 0.0 111.231 174.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.0 mt -70.9 -42.91 69.33 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.796 0.838 . . . . 0.0 111.428 175.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -60.89 -40.98 95.13 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.99 -1.069 . . . . 0.0 111.797 169.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -60.55 -33.3 72.48 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.613 1.097 . . . . 0.0 112.714 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.8 tp -76.23 -30.18 57.82 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.858 1.263 . . . . 0.0 113.86 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -123.65 -13.11 7.56 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 116.662 2.097 . . . . 0.0 116.662 -169.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 32.3 t -58.08 -22.19 49.38 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.327 1.421 . . . . 0.0 113.635 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -54.77 -25.83 30.44 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 171.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -86.94 -18.73 30.07 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 177.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 140.22 -159.61 26.19 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.5 1.048 . . . . 0.0 113.496 -179.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -74.77 62.72 1.1 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.401 1.48 . . . . 0.0 112.281 172.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 1.2 pp -59.08 168.55 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 126.862 2.065 . . . . 0.0 113.497 178.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -130.74 150.59 51.85 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.934 1.294 . . . . 0.0 110.648 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 61.5 mt -130.97 133.19 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.217 1.407 . . . . 0.0 109.077 -174.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 45.9 m -134.94 98.21 3.95 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.387 1.475 . . . . 0.0 111.135 -177.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -57.84 148.52 25.04 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.778 1.231 . . . . 0.0 113.942 178.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 33.0 pt -135.36 -19.26 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.059 1.343 . . . . 0.0 113.872 170.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -152.88 176.93 11.3 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.776 1.231 . . . . 0.0 111.597 172.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -64.95 -12.54 50.84 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.895 1.678 . . . . 0.0 113.51 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.7 p -136.97 5.56 2.82 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.225 2.21 . . . . 0.0 113.234 -173.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 75.2 m -146.38 138.59 25.05 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.421 1.088 . . . . 0.0 113.156 -172.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.76 157.79 41.34 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.679 1.192 . . . . 0.0 112.398 176.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -89.9 154.84 19.55 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.755 0.822 . . . . 0.0 110.027 167.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.4 t -137.67 124.3 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.359 1.064 . . . . 0.0 110.15 175.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 7.5 t -93.8 132.71 37.93 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.785 1.234 . . . . 0.0 110.751 177.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 50.4 mt -111.85 161.1 16.72 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.352 1.461 . . . . 0.0 111.129 178.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 38.5 m -67.79 -25.92 65.83 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -174.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -145.55 153.98 52.0 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.187 1.395 . . . . 0.0 111.963 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.17 -20.85 32.36 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.23 2.62 . . . . 0.0 113.632 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -63.17 -35.3 79.83 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.79 -1.194 . . . . 0.0 111.818 171.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -69.35 -28.14 65.95 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.267 -0.896 . . . . 0.0 112.734 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.4 -43.68 98.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.586 0.754 . . . . 0.0 111.151 170.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 22.4 tm0? -61.39 -41.62 97.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.75 0.705 . . . . 0.0 111.588 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 95.8 mt -62.19 -47.79 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.368 0.667 . . . . 0.0 111.003 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.79 87.74 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.179 0.9 . . . . 0.0 113.383 178.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.23 -27.6 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.181 0.993 . . . . 0.0 112.117 173.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -74.53 -46.85 36.43 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 120.935 -1.103 . . . . 0.0 112.144 169.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 57.4 p -74.34 -21.23 59.79 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -174.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 84.8 p -59.49 -23.15 62.53 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -59.67 -17.75 36.57 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.198 1.399 . . . . 0.0 114.102 173.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -100.49 -0.48 37.83 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.961 1.305 . . . . 0.0 113.618 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -67.11 155.59 38.34 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.012 0.925 . . . . 0.0 112.943 176.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -138.22 -4.22 1.71 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.218 1.407 . . . . 0.0 112.7 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 70.7 p -141.75 5.54 1.78 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.902 1.681 . . . . 0.0 114.1 -172.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -156.68 169.33 24.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.273 1.829 . . . . 0.0 111.055 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 -141.1 149.33 41.44 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.147 2.179 . . . . 0.0 110.411 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 86.8 mt -137.65 142.82 35.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.633 1.573 . . . . 0.0 110.098 -177.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -144.22 164.48 30.6 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.51 1.924 . . . . 0.0 109.566 168.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 20.3 p -71.0 162.05 30.08 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 120.374 -1.454 . . . . 0.0 111.775 174.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -58.17 -36.97 73.81 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.265 -0.897 . . . . 0.0 111.834 169.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.73 92.22 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 123.643 0.777 . . . . 0.0 113.068 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.7 -39.75 95.08 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.379 -0.826 . . . . 0.0 112.029 173.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 82.5 t80 . . . . . 0 CA--C 1.541 0.63 0 C-N-CA 122.941 0.496 . . . . 0.0 112.067 172.965 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 69.2 mtt85 . . . . . 0 N--CA 1.483 1.189 0 N-CA-C 113.523 0.934 . . . . 0.0 113.523 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.79 -19.75 64.33 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 121.029 -1.044 . . . . 0.0 113.327 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 38.4 p-80 -94.66 12.71 26.76 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.546 2.338 . . . . 0.0 113.795 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 29.3 t -120.11 141.96 37.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.108 1.363 . . . . 0.0 111.656 -171.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 65.7 mt -117.13 166.68 11.94 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 127.388 2.275 . . . . 0.0 110.975 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -123.92 142.24 51.32 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 126.779 2.031 . . . . 0.0 107.883 167.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.3 t -134.74 138.6 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 124.999 1.319 . . . . 0.0 109.024 -171.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 3.7 m -125.44 135.79 52.71 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.828 1.251 . . . . 0.0 109.621 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -155.49 153.35 26.36 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 124.689 1.196 . . . . 0.0 112.059 -169.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -52.42 147.51 29.13 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.818 3.012 . . . . 0.0 113.209 169.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -57.95 -18.7 25.14 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.367 1.618 . . . . 0.0 115.367 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -81.27 -15.74 54.64 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.561 1.544 . . . . 0.0 114.0 178.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 6.6 m95 -61.43 151.38 32.72 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.224 0.92 . . . . 0.0 112.323 175.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -119.1 165.32 14.31 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.005 1.722 . . . . 0.0 111.869 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.7 m -51.77 -34.57 40.22 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.991 1.316 . . . . 0.0 111.509 168.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.8 m -65.99 -41.73 90.7 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 175.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -64.98 -31.39 72.6 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.599 -0.688 . . . . 0.0 111.183 173.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 72.8 mt -70.5 -47.41 60.65 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.653 0.781 . . . . 0.0 111.359 174.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -59.91 -32.04 70.38 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.93 -1.106 . . . . 0.0 113.064 171.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -69.86 -42.67 73.22 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.148 0.886 . . . . 0.0 112.113 172.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 55.6 tp -62.11 -33.57 74.69 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.162 1.385 . . . . 0.0 112.253 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -108.28 12.91 26.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.663 1.185 . . . . 0.0 113.536 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 23.2 t -56.3 -30.32 62.37 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.026 1.33 . . . . 0.0 113.281 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.64 -14.81 9.25 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.637 1.575 . . . . 0.0 115.081 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -111.26 -4.71 14.86 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.9 1.28 . . . . 0.0 113.684 -175.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 72.86 -31.07 0.75 Allowed Glycine 0 CA--C 1.539 1.556 0 C-N-CA 126.425 1.964 . . . . 0.0 117.196 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -148.07 129.23 14.6 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.862 1.665 . . . . 0.0 110.624 -176.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.8 pt -146.07 173.5 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.556 1.542 . . . . 0.0 112.089 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -142.0 144.5 33.7 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.298 1.439 . . . . 0.0 108.59 167.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 49.7 mt -127.42 133.7 67.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.192 0.997 . . . . 0.0 109.993 -172.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 70.6 m -136.9 103.25 5.11 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.551 1.541 . . . . 0.0 110.529 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -60.73 158.85 11.93 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.768 1.227 . . . . 0.0 114.249 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.8 -28.68 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.694 1.197 . . . . 0.0 112.252 171.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -154.1 -178.5 7.14 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.878 1.271 . . . . 0.0 111.471 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.74 -19.68 62.7 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.892 1.277 . . . . 0.0 113.065 171.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.8 p -132.31 5.64 4.11 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.99 2.116 . . . . 0.0 113.525 -169.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 18.9 m -144.08 139.88 29.17 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.667 1.187 . . . . 0.0 113.126 -175.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.13 155.2 38.42 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.241 1.416 . . . . 0.0 112.074 174.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -89.4 149.74 22.85 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.421 1.088 . . . . 0.0 109.67 167.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 58.2 t -137.3 115.52 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.281 1.032 . . . . 0.0 110.314 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 67.9 m -80.6 142.51 33.98 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.489 1.116 . . . . 0.0 110.838 170.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 68.6 mt -119.76 160.73 22.02 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.118 1.367 . . . . 0.0 110.843 172.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 65.4 m -61.57 -27.45 68.64 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.049 1.5 . . . . 0.0 115.049 -175.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -144.37 152.65 54.27 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.139 1.376 . . . . 0.0 111.573 176.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.24 -12.83 36.22 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.891 3.06 . . . . 0.0 114.032 172.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.5 -38.84 88.12 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.749 -1.219 . . . . 0.0 111.683 169.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -74.62 -25.33 59.16 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.637 0.775 . . . . 0.0 112.788 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.85 -44.15 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.437 1.495 . . . . 0.0 111.179 171.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -65.41 -36.18 83.17 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.014 0.925 . . . . 0.0 112.045 178.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 61.3 mt -64.72 -47.92 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.316 1.047 . . . . 0.0 110.49 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.38 -34.85 79.12 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.8 -41.14 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 O-C-N 121.058 -1.027 . . . . 0.0 111.11 170.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -62.66 -42.58 99.69 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -72.96 -31.38 64.52 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.739 0.816 . . . . 0.0 113.028 -178.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 10.3 t -65.04 -16.39 63.39 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 174.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -55.29 -21.88 16.4 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.383 1.473 . . . . 0.0 114.001 176.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -124.79 16.41 8.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.78 1.632 . . . . 0.0 112.994 -175.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.22 159.47 17.65 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.293 1.037 . . . . 0.0 113.113 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -135.8 -8.92 2.12 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.027 1.331 . . . . 0.0 113.098 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 71.4 p -140.54 2.43 1.82 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.497 1.519 . . . . 0.0 114.432 -172.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -157.49 176.07 13.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.438 1.895 . . . . 0.0 110.794 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -147.55 147.21 29.86 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.309 1.444 . . . . 0.0 110.827 169.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 76.0 mt -129.77 142.05 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 126.237 1.815 . . . . 0.0 109.694 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -146.55 163.14 36.71 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.789 1.636 . . . . 0.0 110.79 170.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 19.2 p -71.1 164.97 24.53 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 120.644 -1.285 . . . . 0.0 112.192 173.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -58.61 -39.4 80.35 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 121.038 -1.039 . . . . 0.0 111.983 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.8 -34.29 78.0 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.802 0.841 . . . . 0.0 113.195 177.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -71.84 -40.66 68.91 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.349 -0.845 . . . . 0.0 112.142 170.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 33.7 t80 . . . . . 0 N--CA 1.47 0.543 0 C-N-CA 124.954 1.302 . . . . 0.0 113.559 177.911 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.9 -17.75 64.87 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -173.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 38.1 p-80 -100.17 14.41 30.9 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.434 2.294 . . . . 0.0 113.352 176.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 23.4 t -120.54 133.28 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.665 1.186 . . . . 0.0 111.649 -170.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 94.1 mt -103.81 166.63 10.29 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.842 2.057 . . . . 0.0 111.669 175.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -125.32 138.75 54.07 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 127.371 2.268 . . . . 0.0 107.413 167.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.2 t -135.61 138.64 47.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 C-N-CA 124.822 1.249 . . . . 0.0 109.165 -170.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 6.9 m -126.62 131.25 51.52 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.919 1.288 . . . . 0.0 109.23 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -150.51 160.37 32.93 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.678 1.191 . . . . 0.0 112.925 -168.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -54.13 156.59 12.76 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 124.658 3.572 . . . . 0.0 115.32 177.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -58.01 -12.64 3.52 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.396 1.878 . . . . 0.0 115.913 174.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -117.63 -1.03 11.71 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.791 1.636 . . . . 0.0 113.848 -177.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 1.7 m0 -66.81 154.28 41.25 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.223 -0.923 . . . . 0.0 111.874 169.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -129.54 166.47 19.61 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.097 1.359 . . . . 0.0 113.278 -174.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.3 m -47.29 -33.38 5.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.909 1.684 . . . . 0.0 112.865 170.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 20.2 p -72.9 -41.06 65.0 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -60.49 -28.23 68.2 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.551 0.614 . . . . 0.0 110.33 168.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.2 mt -78.36 -46.2 20.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.544 0.338 . . . . 0.0 111.782 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -58.11 -39.64 79.15 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.055 -1.028 . . . . 0.0 111.989 169.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -64.37 -34.45 78.18 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.166 0.893 . . . . 0.0 112.869 174.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 44.1 tp -71.52 -28.9 64.21 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.172 0.989 . . . . 0.0 113.141 177.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -121.7 3.85 10.08 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 -172.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 75.3 p -56.77 -24.57 51.22 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.12 -15.06 8.17 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.568 1.547 . . . . 0.0 114.624 173.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -106.15 3.55 28.09 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.342 1.457 . . . . 0.0 113.861 -177.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 82.55 -45.44 3.38 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.879 1.704 . . . . 0.0 115.572 169.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -150.85 143.91 24.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.935 1.294 . . . . 0.0 111.127 177.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 24.1 pt -144.78 171.42 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 125.209 1.404 . . . . 0.0 112.076 -175.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -138.33 105.68 5.52 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.244 1.018 . . . . 0.0 109.521 167.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.9 mt -74.53 135.72 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.094 0.958 . . . . 0.0 108.477 172.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.7 m -138.99 96.71 3.16 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.503 1.921 . . . . 0.0 109.523 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -58.18 155.94 10.51 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -173.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 8.5 mt -131.72 -41.1 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.177 1.391 . . . . 0.0 110.054 176.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -156.49 179.89 8.83 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.443 1.497 . . . . 0.0 111.441 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -56.23 -20.26 17.52 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.619 1.968 . . . . 0.0 114.087 173.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.6 p -131.42 4.02 4.29 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.273 1.829 . . . . 0.0 113.778 -173.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 69.5 m -144.4 139.42 28.4 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.12 0.968 . . . . 0.0 112.894 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -149.88 152.02 34.39 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.669 1.188 . . . . 0.0 112.24 175.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -89.42 151.73 21.87 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.829 0.852 . . . . 0.0 108.788 167.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 49.3 t -140.51 111.14 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.867 0.867 . . . . 0.0 110.591 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 72.4 m -73.84 143.71 45.8 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.796 0.838 . . . . 0.0 110.629 169.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 67.3 mt -118.81 164.63 15.12 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.701 1.6 . . . . 0.0 110.516 171.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 63.3 m -62.71 -28.86 70.24 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -144.35 152.75 54.6 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 124.701 1.2 . . . . 0.0 112.346 -177.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.94 -16.67 32.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.457 2.771 . . . . 0.0 113.807 173.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.41 -38.48 90.05 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.946 -1.096 . . . . 0.0 111.813 170.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -67.13 -31.04 71.22 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.259 1.024 . . . . 0.0 112.338 179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 43.4 t -58.28 -40.04 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.986 0.914 . . . . 0.0 111.283 171.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -65.77 -38.37 88.87 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.62 -0.675 . . . . 0.0 111.683 178.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 78.8 mt -65.3 -44.51 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.236 1.014 . . . . 0.0 110.669 175.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.21 -41.14 99.1 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.324 -0.86 . . . . 0.0 112.868 176.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 57.8 t -67.52 -31.56 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.147 0.979 . . . . 0.0 112.303 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -69.4 -49.73 52.61 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.028 -1.045 . . . . 0.0 111.854 171.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 23.7 p -71.37 -24.46 62.09 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -174.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 60.1 p -67.1 -14.29 62.76 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 176.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -59.88 -16.14 26.88 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.81 1.244 . . . . 0.0 113.734 169.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -119.17 10.95 12.21 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.628 1.571 . . . . 0.0 112.777 -172.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.68 164.24 10.13 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.97 1.308 . . . . 0.0 112.657 170.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -136.53 -27.95 1.03 Allowed 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -177.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 42.9 m -133.4 5.65 3.77 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.673 1.189 . . . . 0.0 113.856 -175.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -150.41 176.16 11.18 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.581 1.952 . . . . 0.0 110.468 -176.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -144.27 150.77 38.43 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.547 1.139 . . . . 0.0 111.397 173.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 34.2 mt -133.87 140.1 47.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.345 1.858 . . . . 0.0 108.541 177.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -149.65 172.43 15.06 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.101 1.76 . . . . 0.0 110.319 174.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 32.3 p -72.61 163.14 28.54 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.715 -1.241 . . . . 0.0 111.959 171.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -54.54 -41.66 70.02 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.267 -0.896 . . . . 0.0 111.848 169.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.76 -35.76 80.85 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.68 -33.2 73.56 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.024 -1.048 . . . . 0.0 112.926 175.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 81.9 t80 . . . . . 0 CA--C 1.541 0.601 0 O-C-N 121.721 -0.612 . . . . 0.0 111.813 170.46 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -63.04 -14.29 46.28 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 177.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -93.62 7.7 43.7 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.701 1.6 . . . . 0.0 114.0 173.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 19.0 t -117.64 139.07 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.711 1.204 . . . . 0.0 111.772 -170.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.7 mt -113.15 166.3 11.57 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.711 2.004 . . . . 0.0 111.537 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -127.72 140.9 51.78 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.526 2.331 . . . . 0.0 107.88 168.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.2 t -136.18 141.04 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.959 1.304 . . . . 0.0 109.498 -169.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 6.7 m -134.14 136.14 43.62 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.724 1.209 . . . . 0.0 109.848 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.7 p90 -158.86 159.04 29.59 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.277 1.031 . . . . 0.0 112.679 -169.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -52.6 147.53 30.27 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 124.225 3.284 . . . . 0.0 114.069 171.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -60.72 -12.74 11.41 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 115.854 1.798 . . . . 0.0 115.854 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -75.11 -17.59 60.4 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.879 1.272 . . . . 0.0 113.953 176.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -65.39 154.77 37.43 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -178.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -119.79 164.81 15.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 127.044 2.138 . . . . 0.0 111.697 173.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.6 m -55.81 -31.64 62.85 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.163 0.985 . . . . 0.0 110.908 168.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.0 m -64.53 -40.85 96.37 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 172.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -66.49 -30.24 70.53 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.613 -0.679 . . . . 0.0 111.202 173.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 49.7 mt -70.5 -44.81 66.86 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.354 0.662 . . . . 0.0 111.542 173.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -57.73 -39.61 77.71 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 120.993 -1.067 . . . . 0.0 111.962 169.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 64.3 tp60 -67.82 -33.18 74.28 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.075 0.852 . . . . 0.0 113.257 175.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.5 tp -69.87 -32.02 70.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.467 1.107 . . . . 0.0 112.725 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -115.96 6.02 14.08 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -172.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 79.2 p -58.54 -23.85 59.24 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.941 1.297 . . . . 0.0 114.349 175.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.23 -13.09 4.33 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.622 1.569 . . . . 0.0 114.38 172.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -114.21 5.23 15.8 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.847 1.659 . . . . 0.0 113.304 -176.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 72.02 -122.57 9.08 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.473 1.035 . . . . 0.0 112.576 177.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -60.64 128.48 36.81 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.412 1.085 . . . . 0.0 111.862 173.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 28.4 pt -142.67 167.52 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.807 1.643 . . . . 0.0 110.894 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -137.98 99.51 3.91 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.155 1.382 . . . . 0.0 110.537 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 56.3 mt -79.74 143.2 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.612 1.565 . . . . 0.0 109.644 177.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 7.9 t -141.14 111.61 6.89 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.937 1.295 . . . . 0.0 111.399 175.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -62.39 154.2 28.91 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 7.3 mt -132.68 -44.34 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.982 1.313 . . . . 0.0 110.115 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -153.03 177.38 10.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.326 1.85 . . . . 0.0 109.416 170.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.26 1.13 2.3 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -174.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 69.1 p -138.09 5.29 2.54 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 127.259 2.224 . . . . 0.0 113.199 -175.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 88.2 p -154.2 149.36 26.94 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.39 152.48 33.16 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.109 1.364 . . . . 0.0 111.919 -176.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -89.42 153.96 20.43 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 166.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 40.6 t -139.54 109.73 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.548 0.739 . . . . 0.0 110.081 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 24.7 m -77.33 132.76 38.75 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.358 1.063 . . . . 0.0 109.53 168.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 77.0 mt -112.35 158.59 19.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.997 1.319 . . . . 0.0 110.516 176.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 58.5 m -68.12 -21.5 64.94 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -174.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -143.28 150.75 52.99 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 124.896 1.278 . . . . 0.0 111.751 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.74 -16.54 37.7 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.463 2.775 . . . . 0.0 113.747 175.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -65.58 -36.51 83.98 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.038 -1.039 . . . . 0.0 112.161 171.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -69.35 -31.88 70.6 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.456 1.102 . . . . 0.0 112.073 -178.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.01 -42.01 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.806 1.242 . . . . 0.0 111.462 171.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 52.8 mm-40 -64.52 -39.17 93.29 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.886 -0.509 . . . . 0.0 111.697 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.98 -48.29 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 124.218 1.007 . . . . 0.0 110.507 177.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.52 -36.97 85.54 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.4 t -64.55 -40.14 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 121.188 -0.945 . . . . 0.0 111.194 171.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -63.48 -47.66 80.86 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.774 0.715 . . . . 0.0 112.58 175.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.7 p -69.54 -29.51 67.12 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -175.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 11.1 t -62.61 -18.81 62.94 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -60.29 -16.55 35.37 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -123.53 8.17 8.95 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.765 1.626 . . . . 0.0 112.724 -173.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -66.84 155.29 38.7 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.107 1.363 . . . . 0.0 112.74 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -133.61 -9.56 2.81 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.681 1.193 . . . . 0.0 113.994 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 40.4 m -136.87 6.51 2.91 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.205 1.402 . . . . 0.0 113.588 -175.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -160.97 171.84 17.97 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.539 1.936 . . . . 0.0 110.576 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -141.61 151.21 42.92 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.425 1.89 . . . . 0.0 110.451 169.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 62.0 mt -132.7 142.8 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 126.189 1.796 . . . . 0.0 109.6 -179.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -144.6 164.47 30.84 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.02 1.728 . . . . 0.0 110.02 169.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 32.6 p -72.0 164.78 25.51 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 120.604 -1.31 . . . . 0.0 112.065 172.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -59.27 -39.37 82.66 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.943 -1.098 . . . . 0.0 112.095 169.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -63.6 -36.91 85.35 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.64 0.776 . . . . 0.0 112.845 176.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -66.23 -47.14 74.8 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.424 -0.798 . . . . 0.0 111.854 169.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 42.4 t80 . . . . . 0 N--CA 1.469 0.482 0 CA-C-N 118.687 0.676 . . . . 0.0 112.378 179.851 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.1 mmt-85 . . . . . 0 N--CA 1.483 1.188 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -62.36 -23.13 66.63 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.074 0.95 . . . . 0.0 113.492 179.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -99.99 12.84 35.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.834 2.054 . . . . 0.0 113.227 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 38.3 t -118.96 137.28 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.746 1.218 . . . . 0.0 111.818 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 61.3 mt -117.33 166.26 12.51 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 127.121 2.168 . . . . 0.0 110.762 175.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -124.46 142.33 51.4 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 127.362 2.265 . . . . 0.0 107.935 168.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 9.2 t -134.03 138.29 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.638 1.175 . . . . 0.0 109.235 -173.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.3 m -123.09 135.16 54.27 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.858 1.263 . . . . 0.0 109.898 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -158.7 157.3 28.4 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.485 1.114 . . . . 0.0 112.512 -170.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.18 146.03 73.31 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.783 2.989 . . . . 0.0 112.485 168.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -58.44 -18.86 31.75 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 -177.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -64.34 -19.25 65.33 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.724 1.209 . . . . 0.0 113.913 175.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 16.3 m95 -67.39 162.46 22.95 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.471 1.108 . . . . 0.0 113.151 175.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -143.1 169.92 16.69 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 127.255 2.222 . . . . 0.0 110.947 178.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.2 m -51.45 -30.79 20.84 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.292 1.837 . . . . 0.0 112.121 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 14.4 p -74.76 -43.04 56.94 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 177.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -61.15 -26.09 67.46 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.91 -0.494 . . . . 0.0 110.702 169.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 76.1 mt -78.78 -44.51 23.07 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 122.772 0.429 . . . . 0.0 111.477 176.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -57.14 -37.22 71.71 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.029 -1.045 . . . . 0.0 112.143 169.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -68.45 -37.75 80.5 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.943 0.897 . . . . 0.0 113.058 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 59.6 tp -68.36 -28.49 67.17 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.328 1.051 . . . . 0.0 112.975 176.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -117.23 8.74 13.27 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -172.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 81.8 p -58.14 -27.26 63.61 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.68 -18.23 40.5 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.243 1.417 . . . . 0.0 114.63 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -94.11 0.58 55.94 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.878 1.271 . . . . 0.0 114.267 -177.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.97 -45.85 3.39 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.837 1.684 . . . . 0.0 115.182 169.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -150.55 133.83 16.27 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.927 1.291 . . . . 0.0 110.78 175.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 15.4 pt -143.48 171.93 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.468 1.507 . . . . 0.0 111.367 -174.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -138.77 152.14 47.68 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.723 1.609 . . . . 0.0 110.302 169.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 76.2 mt -134.08 139.64 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.082 1.353 . . . . 0.0 109.707 -169.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 7.0 t -144.42 107.24 4.46 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.047 0.939 . . . . 0.0 112.588 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -63.23 148.89 46.87 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 37.0 pt -134.8 -20.93 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.939 1.296 . . . . 0.0 113.714 171.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -153.19 178.77 9.38 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.842 1.257 . . . . 0.0 111.229 173.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -66.84 -15.46 63.63 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.59 1.156 . . . . 0.0 112.698 174.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 39.5 p -132.57 8.47 4.22 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.656 1.982 . . . . 0.0 112.976 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 3.7 m -149.34 142.67 25.18 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.564 1.146 . . . . 0.0 113.543 -177.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.29 160.47 43.79 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.514 1.526 . . . . 0.0 111.377 174.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -89.34 154.57 19.98 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.808 0.843 . . . . 0.0 110.116 168.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 60.9 t -133.8 112.23 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 124.543 1.137 . . . . 0.0 109.164 171.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 37.7 m -85.7 135.11 33.89 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.655 1.582 . . . . 0.0 109.945 172.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 79.4 mt -118.64 164.01 15.96 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.973 1.309 . . . . 0.0 111.458 -177.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 58.1 m -69.44 -22.36 63.67 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -177.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -146.75 151.32 42.11 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.185 1.394 . . . . 0.0 112.351 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.19 -19.53 33.95 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.481 2.787 . . . . 0.0 113.303 173.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -64.09 -36.27 83.46 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.601 -1.312 . . . . 0.0 111.897 169.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -68.98 -31.7 70.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.061 0.944 . . . . 0.0 112.244 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 86.8 t -57.7 -46.38 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 125.09 1.356 . . . . 0.0 110.753 172.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -63.46 -41.67 98.61 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.263 0.625 . . . . 0.0 112.223 177.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 95.6 mt -62.51 -44.04 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.925 0.89 . . . . 0.0 111.213 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -65.23 -39.45 92.74 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.074 -1.016 . . . . 0.0 113.082 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 80.6 t -65.54 -40.94 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 121.189 -0.944 . . . . 0.0 111.49 174.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -62.01 -48.11 81.78 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.353 1.061 . . . . 0.0 112.533 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 25.4 p -73.16 -27.96 61.96 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.025 0.93 . . . . 0.0 113.151 -175.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.1 t -64.65 -14.91 60.22 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 171.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -60.75 -14.38 20.9 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.686 1.194 . . . . 0.0 113.431 169.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -114.12 8.26 16.92 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.493 1.917 . . . . 0.0 112.871 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.66 160.96 21.57 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.857 1.263 . . . . 0.0 113.122 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.66 -7.82 1.1 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 32.6 m -140.89 8.73 2.12 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.135 1.374 . . . . 0.0 113.631 -178.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 55.6 p90 -160.01 173.89 15.18 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.243 1.817 . . . . 0.0 110.841 -176.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -147.73 143.47 27.6 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.036 1.334 . . . . 0.0 110.826 169.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 71.8 mt -120.35 137.18 54.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 126.222 1.809 . . . . 0.0 109.322 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -147.21 169.06 20.15 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.106 1.363 . . . . 0.0 111.293 174.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 43.9 p -71.73 162.66 29.1 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.945 -1.097 . . . . 0.0 112.652 176.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -56.28 -37.08 69.36 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.605 0.762 . . . . 0.0 112.322 169.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -68.02 -40.0 83.02 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.046 0.938 . . . . 0.0 113.152 176.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -67.77 -32.83 73.68 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.045 -1.034 . . . . 0.0 112.505 174.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 21.2 t80 . . . . . 0 CA--C 1.541 0.597 0 C-N-CA 124.064 0.946 . . . . 0.0 111.796 170.327 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 78.7 mtm-85 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -63.95 -16.36 61.35 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.466 1.107 . . . . 0.0 113.521 174.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -89.12 11.0 19.79 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.912 2.085 . . . . 0.0 113.83 172.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 44.1 t -121.96 137.23 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 125.169 1.388 . . . . 0.0 110.734 -176.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.7 mt -98.73 162.67 12.99 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 125.871 1.668 . . . . 0.0 111.95 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -118.34 138.45 52.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 127.658 2.383 . . . . 0.0 106.287 166.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.8 t -136.33 139.98 44.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 124.233 1.013 . . . . 0.0 109.417 -169.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.7 m -131.24 134.04 46.05 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.18 1.392 . . . . 0.0 109.699 -178.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -157.5 158.43 30.65 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 124.273 1.029 . . . . 0.0 112.504 -169.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -55.81 144.76 75.67 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.318 2.679 . . . . 0.0 111.923 168.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -55.39 -24.4 29.71 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 115.316 1.598 . . . . 0.0 115.316 -176.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -63.15 -21.21 66.05 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.149 1.379 . . . . 0.0 113.782 178.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 13.4 m95 -63.69 152.74 38.27 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.081 0.953 . . . . 0.0 112.547 174.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 43.2 mttm -133.56 171.82 13.57 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.211 1.804 . . . . 0.0 111.653 176.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.1 m -50.62 -35.01 28.36 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.341 1.456 . . . . 0.0 112.338 172.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.5 m -65.07 -42.4 94.2 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 175.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.12 -31.45 72.32 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.623 -0.673 . . . . 0.0 111.246 174.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 78.1 mt -70.91 -44.51 66.07 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.884 0.874 . . . . 0.0 111.507 175.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -57.28 -41.97 80.77 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.24 -0.912 . . . . 0.0 111.938 169.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.25 -39.07 92.16 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 118.808 0.731 . . . . 0.0 112.947 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.0 tp -65.98 -35.05 79.53 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.618 1.167 . . . . 0.0 112.398 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -111.71 5.83 19.45 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -173.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 24.5 t -53.63 -30.64 43.77 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.399 1.479 . . . . 0.0 113.515 173.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.6 -12.15 3.79 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 125.778 1.631 . . . . 0.0 115.129 175.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -113.53 3.08 15.58 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.662 1.585 . . . . 0.0 113.534 -177.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 93.74 -151.62 20.39 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.476 1.036 . . . . 0.0 112.686 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -62.28 150.75 38.34 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.584 0.754 . . . . 0.0 112.286 170.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 27.4 pt -144.76 179.21 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 126.061 1.744 . . . . 0.0 111.245 -174.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -137.95 143.53 40.78 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.81 1.244 . . . . 0.0 109.338 168.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.9 mt -127.5 130.99 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.723 1.209 . . . . 0.0 109.456 -171.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 63.7 m -137.58 98.94 3.81 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.447 1.499 . . . . 0.0 110.993 -174.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 94.9 m95 -57.94 152.44 16.23 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.508 1.123 . . . . 0.0 113.923 179.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 36.5 pt -134.05 -22.31 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.778 1.231 . . . . 0.0 113.401 169.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -154.1 178.2 10.23 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.395 1.078 . . . . 0.0 111.982 174.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -66.23 -14.57 62.14 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.756 1.622 . . . . 0.0 113.189 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.2 p -132.76 8.09 4.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.261 1.824 . . . . 0.0 113.434 -175.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 58.0 p -156.75 151.98 26.41 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.84 162.08 41.52 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.656 1.582 . . . . 0.0 112.051 -177.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -94.61 150.58 20.09 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.13 0.972 . . . . 0.0 110.124 167.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 47.5 t -138.99 113.79 8.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.318 1.047 . . . . 0.0 110.848 177.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 50.9 m -76.48 136.22 39.37 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.963 1.305 . . . . 0.0 111.466 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 74.0 mt -118.57 163.92 16.07 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.582 1.553 . . . . 0.0 110.236 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 50.9 m -69.6 -23.45 63.52 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -174.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -148.19 146.39 23.13 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.752 1.221 . . . . 0.0 112.959 -176.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.69 -29.99 73.49 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.786 2.99 . . . . 0.0 114.177 168.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.0 mp0 -60.89 -37.21 81.4 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.944 -1.097 . . . . 0.0 112.073 174.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -70.19 -36.38 74.58 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.379 -0.826 . . . . 0.0 111.62 175.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 15.1 t -58.86 -47.84 88.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.708 0.803 . . . . 0.0 111.223 170.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.72 -41.33 90.6 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.519 0.599 . . . . 0.0 112.255 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 82.8 mt -62.56 -50.55 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.479 0.712 . . . . 0.0 110.983 174.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.92 -36.28 82.85 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 62.6 t -65.35 -41.0 90.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.386 -0.821 . . . . 0.0 111.048 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -64.1 -45.63 87.77 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.14 0.882 . . . . 0.0 112.814 175.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 49.1 p -72.09 -22.07 61.4 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 25.1 p -60.14 -17.33 39.67 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 175.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -52.82 -22.97 6.02 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.506 1.922 . . . . 0.0 113.717 169.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -123.9 20.51 9.2 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.993 1.717 . . . . 0.0 112.715 -175.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.79 -37.75 88.55 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 52.91 -20.68 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 130.014 3.326 . . . . 0.0 118.819 -176.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 51.1 m -136.2 3.63 2.88 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.4 1.48 . . . . 0.0 114.027 -173.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -156.42 177.72 11.14 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.103 2.161 . . . . 0.0 109.85 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -143.76 150.22 38.27 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.929 1.292 . . . . 0.0 111.022 175.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 92.0 mt -129.52 145.37 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.554 1.542 . . . . 0.0 110.079 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -141.16 170.19 16.19 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.799 2.44 . . . . 0.0 108.731 172.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 31.9 p -79.29 163.92 24.53 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.495 -1.378 . . . . 0.0 110.069 167.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -55.95 -43.32 77.35 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.378 -0.826 . . . . 0.0 111.678 169.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -67.85 -38.88 83.7 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -62.64 -38.97 92.36 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.534 1.534 . . . . 0.0 111.769 176.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 93.2 t80 . . . . . 0 CA--C 1.54 0.572 0 C-N-CA 123.318 0.647 . . . . 0.0 112.436 170.708 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? . . . . . 0 N--CA 1.485 1.297 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -65.73 -21.91 66.56 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.238 1.015 . . . . 0.0 113.684 -176.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 -95.0 12.99 26.49 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.425 1.89 . . . . 0.0 113.672 176.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 38.2 t -116.98 134.12 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.422 1.089 . . . . 0.0 111.362 -170.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 89.8 mt -102.2 164.96 11.4 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.593 1.957 . . . . 0.0 111.24 174.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -124.05 138.04 54.5 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 127.196 2.198 . . . . 0.0 107.34 167.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -135.42 138.49 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.695 1.198 . . . . 0.0 109.387 -169.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 10.1 m -127.05 136.03 51.63 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.221 1.408 . . . . 0.0 109.501 -177.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -159.91 158.93 27.3 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 124.128 0.971 . . . . 0.0 113.131 -168.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -58.02 146.42 87.48 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.464 2.776 . . . . 0.0 111.346 167.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.62 -21.29 38.47 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -175.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -62.44 -22.47 66.22 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.697 1.599 . . . . 0.0 113.985 174.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.0 m95 -62.96 148.91 46.14 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 122.07 0.938 . . . . 0.0 113.068 173.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 25.4 mtmm -132.73 166.19 22.78 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.457 1.903 . . . . 0.0 111.377 -172.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.5 m -52.75 -33.68 49.34 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.406 1.083 . . . . 0.0 111.837 169.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 75.5 m -66.61 -45.88 77.69 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.492 1.117 . . . . 0.0 113.912 173.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.54 -34.49 77.91 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.508 -0.745 . . . . 0.0 111.079 175.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 77.3 mt -67.42 -43.86 80.18 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.251 1.02 . . . . 0.0 111.278 173.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.48 -42.09 86.72 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.112 -0.993 . . . . 0.0 112.507 170.67 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -64.97 -30.53 71.53 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.168 0.894 . . . . 0.0 113.191 175.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 51.6 tp -74.51 -29.88 61.58 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.554 1.142 . . . . 0.0 113.262 175.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -122.01 -4.34 9.05 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -169.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 83.0 p -57.96 -23.27 53.0 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 120.064 1.302 . . . . 0.0 114.256 174.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.13 -14.63 7.25 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.64 1.576 . . . . 0.0 114.345 171.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -109.86 3.07 20.29 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.888 1.675 . . . . 0.0 113.309 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 101.87 -158.53 18.43 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.822 1.201 . . . . 0.0 112.801 -176.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -63.53 152.89 37.33 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.428 0.691 . . . . 0.0 112.199 170.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 31.4 pt -143.93 174.64 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.485 1.514 . . . . 0.0 111.659 -173.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -137.24 151.57 48.88 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.433 1.493 . . . . 0.0 110.177 168.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 71.5 mt -136.17 131.19 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 124.479 1.112 . . . . 0.0 110.303 -169.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 51.7 m -137.54 103.73 5.13 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.131 1.772 . . . . 0.0 109.763 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 61.4 m95 -75.32 160.44 30.32 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.54 -0.725 . . . . 0.0 112.852 -174.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 29.9 pt -135.48 -18.94 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.807 1.243 . . . . 0.0 113.677 175.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -151.65 179.05 8.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.651 1.18 . . . . 0.0 111.737 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -69.23 -10.8 59.48 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.563 1.545 . . . . 0.0 113.05 170.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 39.9 p -135.43 3.34 3.06 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.839 1.656 . . . . 0.0 113.929 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 89.1 p -155.15 155.37 33.83 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 170.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -154.15 160.37 41.86 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.195 1.398 . . . . 0.0 112.473 -176.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -91.76 148.88 21.92 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.907 0.883 . . . . 0.0 110.675 168.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 48.8 t -136.42 111.78 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.808 1.243 . . . . 0.0 110.28 178.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 69.8 m -79.07 115.57 18.83 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.666 1.586 . . . . 0.0 110.575 173.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 65.7 mt -82.73 163.61 21.19 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.384 0.673 . . . . 0.0 111.02 169.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 87.5 p -67.47 -21.57 65.52 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 176.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -147.76 145.03 20.03 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.445 1.498 . . . . 0.0 111.691 -177.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -71.54 -18.07 29.59 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.411 2.741 . . . . 0.0 113.372 172.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -62.45 -26.9 68.76 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.043 -1.036 . . . . 0.0 112.789 172.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -92.97 -17.62 23.71 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.546 1.138 . . . . 0.0 113.012 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 28.9 t -57.39 -45.28 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.748 1.219 . . . . 0.0 110.973 171.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -61.73 -34.59 76.09 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.47 0.708 . . . . 0.0 112.753 177.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 47.6 mt -68.23 -46.09 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.613 0.765 . . . . 0.0 110.367 178.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.73 -40.67 97.91 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.432 -0.792 . . . . 0.0 112.725 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 73.1 t -67.98 -32.31 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.014 0.926 . . . . 0.0 112.441 175.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -68.96 -47.91 64.47 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.099 -1.001 . . . . 0.0 112.07 171.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 24.3 p -76.23 -22.81 54.77 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -172.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 55.8 p -61.17 -18.23 57.07 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 175.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -55.59 -19.84 11.59 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.015 1.726 . . . . 0.0 113.601 169.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -122.99 18.76 10.09 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.14 1.776 . . . . 0.0 112.671 -175.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -60.62 162.94 5.9 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.522 1.529 . . . . 0.0 113.913 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -129.74 -15.21 3.96 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -171.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 14.9 t -154.95 10.93 0.35 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.034 1.334 . . . . 0.0 112.75 -176.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -158.07 175.39 13.86 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.124 1.37 . . . . 0.0 111.913 -169.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -145.6 152.44 39.68 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.961 1.704 . . . . 0.0 110.402 169.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 42.2 mt -136.17 142.71 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.44 1.496 . . . . 0.0 110.317 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -146.9 169.13 19.79 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.852 2.061 . . . . 0.0 109.808 169.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 16.8 p -71.8 164.63 25.65 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 120.038 -1.664 . . . . 0.0 112.404 171.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -56.28 -42.25 77.18 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.105 -0.997 . . . . 0.0 111.856 169.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.39 87.19 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.687 0.795 . . . . 0.0 112.94 177.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -64.37 -41.37 96.73 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.352 -0.843 . . . . 0.0 111.965 172.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 66.1 t80 . . . . . 0 CA--C 1.538 0.509 0 CA-C-N 118.973 0.806 . . . . 0.0 111.677 172.72 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.33 -12.72 44.86 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.082 1.353 . . . . 0.0 114.298 -178.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -115.28 13.46 16.67 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.187 2.195 . . . . 0.0 113.062 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 54.7 t -114.24 125.02 71.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.606 1.162 . . . . 0.0 111.153 -170.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.6 mt -92.23 164.11 13.67 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.374 1.47 . . . . 0.0 111.79 170.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -122.41 134.76 54.6 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 127.19 2.196 . . . . 0.0 106.663 166.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.8 t -130.18 136.36 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 125.111 1.364 . . . . 0.0 109.022 -169.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 11.6 m -129.66 135.57 48.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.081 1.353 . . . . 0.0 109.422 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -158.9 158.38 29.04 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 123.904 0.881 . . . . 0.0 112.788 -169.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -56.46 143.23 88.09 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 122.976 2.451 . . . . 0.0 110.82 166.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -58.13 -19.45 32.64 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -176.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -61.52 -21.37 64.17 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.171 1.388 . . . . 0.0 113.946 174.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -64.02 151.1 43.83 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.801 0.84 . . . . 0.0 112.541 172.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -136.64 167.66 20.99 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.044 1.738 . . . . 0.0 111.568 179.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.9 m -51.62 -36.38 45.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.242 1.417 . . . . 0.0 112.817 177.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 72.5 m -67.63 -39.12 84.67 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 176.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -67.38 -31.7 72.11 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.319 -0.863 . . . . 0.0 110.965 173.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.3 mt -71.18 -46.24 61.77 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.068 0.947 . . . . 0.0 111.223 176.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -57.16 -37.87 72.72 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.029 -1.044 . . . . 0.0 112.846 171.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -69.72 -37.41 76.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.092 0.957 . . . . 0.0 113.31 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 66.2 tp -62.83 -34.25 76.93 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.559 1.143 . . . . 0.0 112.233 176.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -105.23 5.95 32.53 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 -176.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 21.4 t -54.93 -29.27 55.93 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.908 1.283 . . . . 0.0 113.406 176.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.82 -13.02 5.09 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.81 1.644 . . . . 0.0 115.21 173.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -117.61 5.74 12.41 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.702 1.601 . . . . 0.0 113.168 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 78.19 -148.47 32.9 Favored Glycine 0 CA--C 1.535 1.314 0 O-C-N 121.291 -0.88 . . . . 0.0 112.992 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -59.67 142.5 52.88 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.218 1.007 . . . . 0.0 112.678 177.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 10.2 pt -143.59 177.86 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 126.29 1.836 . . . . 0.0 111.287 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -132.57 144.85 50.67 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.634 1.174 . . . . 0.0 110.048 169.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.1 mt -126.41 131.85 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.157 1.383 . . . . 0.0 109.044 -172.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 56.8 m -134.92 96.43 3.52 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.799 1.64 . . . . 0.0 110.755 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -57.46 150.03 19.59 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.256 1.022 . . . . 0.0 113.209 177.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 38.1 pt -133.16 -19.13 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.658 1.183 . . . . 0.0 113.237 170.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -152.06 170.87 18.87 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.247 1.419 . . . . 0.0 111.785 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -61.46 -17.52 54.83 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.16 1.784 . . . . 0.0 113.097 170.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 72.8 p -130.04 4.1 4.86 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.979 1.712 . . . . 0.0 114.69 -176.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 98.7 p -154.74 157.09 37.5 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 174.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.69 163.18 40.16 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.771 1.629 . . . . 0.0 112.207 -177.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -98.26 151.36 20.56 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.425 1.09 . . . . 0.0 110.18 167.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 89.6 t -139.32 117.85 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.05 0.94 . . . . 0.0 111.088 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 73.2 m -83.16 116.29 22.29 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.55 1.54 . . . . 0.0 110.581 173.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 64.0 mt -85.65 160.4 19.59 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.169 0.987 . . . . 0.0 111.649 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 93.7 p -73.01 -19.83 61.12 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -142.27 149.14 50.59 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.48 1.512 . . . . 0.0 110.925 174.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -70.25 -23.71 28.26 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.943 2.428 . . . . 0.0 113.645 179.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -63.68 -30.05 71.2 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.944 -1.097 . . . . 0.0 112.679 175.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -69.56 -24.44 63.7 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.09 1.356 . . . . 0.0 112.685 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.69 -47.46 91.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.398 1.079 . . . . 0.0 110.987 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -62.13 -37.94 87.06 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.103 0.561 . . . . 0.0 112.068 177.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 68.0 mt -62.04 -54.72 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.732 0.813 . . . . 0.0 110.143 176.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.15 86.13 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -178.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 65.0 t -63.8 -45.09 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.239 -0.913 . . . . 0.0 110.922 172.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.73 -45.93 91.81 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.72 0.808 . . . . 0.0 112.93 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.9 p -70.17 -22.78 62.93 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.269 1.028 . . . . 0.0 113.513 -177.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 47.5 m -90.0 -6.56 55.47 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -177.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt -56.41 -16.4 5.7 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 172.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -126.49 9.93 7.22 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.967 1.707 . . . . 0.0 113.035 -173.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.4 156.16 33.14 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.801 1.241 . . . . 0.0 112.795 177.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -131.28 -6.74 3.81 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 43.0 m -132.3 1.78 3.83 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.204 1.402 . . . . 0.0 113.511 -177.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 45.8 p90 -163.02 174.39 12.35 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.812 2.445 . . . . 0.0 109.621 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -147.6 148.21 30.88 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.567 1.547 . . . . 0.0 110.868 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 74.7 mt -131.7 144.98 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 125.684 1.593 . . . . 0.0 110.505 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -147.17 170.56 16.97 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.933 2.093 . . . . 0.0 109.87 171.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 20.9 p -73.5 162.92 28.72 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.576 -1.328 . . . . 0.0 111.716 172.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -55.1 -41.15 71.24 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.409 -0.807 . . . . 0.0 112.156 169.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -70.02 -38.02 75.78 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 179.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -64.38 -41.27 96.78 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.413 -0.805 . . . . 0.0 111.698 173.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 25.5 t80 . . . . . 0 CA--C 1.541 0.6 0 C-N-CA 123.423 0.689 . . . . 0.0 111.791 172.089 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 . . . . . 0 N--CA 1.483 1.22 0 CA-C-O 121.471 0.653 . . . . 0.0 112.699 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -59.74 -22.23 61.79 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.69 1.196 . . . . 0.0 113.782 176.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 -82.53 7.54 14.2 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.545 1.938 . . . . 0.0 114.285 173.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 19.6 t -123.39 140.79 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 125.064 1.345 . . . . 0.0 111.509 -170.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 82.2 mt -115.43 164.69 13.92 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 127.573 2.349 . . . . 0.0 110.499 176.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -122.88 140.86 52.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.556 1.942 . . . . 0.0 108.246 168.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.5 t -133.47 138.16 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 124.772 1.229 . . . . 0.0 109.202 -170.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 12.1 m -128.19 137.91 52.25 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.142 1.377 . . . . 0.0 109.511 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -158.8 158.66 29.38 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.184 0.994 . . . . 0.0 112.38 -169.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -54.98 142.51 76.11 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.258 2.639 . . . . 0.0 111.89 168.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -57.0 -21.22 28.99 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.61 -20.66 66.4 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.013 1.325 . . . . 0.0 114.006 174.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -64.81 151.79 44.47 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.817 0.847 . . . . 0.0 112.194 173.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -133.26 171.9 13.41 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.902 1.681 . . . . 0.0 112.054 177.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.7 m -50.7 -35.03 29.13 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.475 1.51 . . . . 0.0 112.399 174.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.6 m -63.9 -44.76 92.04 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 174.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -65.48 -31.14 72.05 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.353 0.661 . . . . 0.0 111.391 175.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 83.6 mt -72.2 -45.87 58.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.804 0.842 . . . . 0.0 111.587 176.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.1 -36.17 74.69 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.101 -0.999 . . . . 0.0 112.616 170.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -68.28 -39.37 82.17 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.886 0.766 . . . . 0.0 112.842 174.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 48.4 tp -65.99 -40.82 91.51 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.713 1.205 . . . . 0.0 112.028 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -99.62 9.71 42.66 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.022 0.929 . . . . 0.0 113.471 -177.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 21.7 t -54.84 -31.48 59.52 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.459 1.504 . . . . 0.0 113.599 177.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.48 -14.0 6.87 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.585 1.554 . . . . 0.0 115.081 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -106.42 0.77 25.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.261 1.425 . . . . 0.0 113.767 -177.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.86 -47.19 3.26 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 126.097 1.808 . . . . 0.0 115.81 169.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -144.07 137.64 27.72 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.421 1.489 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 22.1 pt -146.5 174.92 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.386 1.474 . . . . 0.0 111.851 -172.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -143.8 148.04 35.0 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.942 1.297 . . . . 0.0 109.071 167.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 49.8 mt -130.9 136.28 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.257 1.023 . . . . 0.0 110.095 -173.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 37.5 m -135.13 102.75 5.3 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.745 1.618 . . . . 0.0 110.652 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -59.32 150.47 25.97 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.024 0.93 . . . . 0.0 113.486 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 36.8 pt -135.28 -21.07 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.632 1.173 . . . . 0.0 113.874 170.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -152.27 178.97 8.94 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.684 1.194 . . . . 0.0 112.013 175.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -68.27 -14.09 62.73 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.752 1.221 . . . . 0.0 113.234 173.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.2 p -132.94 3.52 3.75 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.637 1.575 . . . . 0.0 113.769 -172.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 97.1 p -154.26 155.91 36.07 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 174.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.47 159.51 42.32 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.025 1.73 . . . . 0.0 111.61 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -89.8 150.16 22.38 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.68 0.792 . . . . 0.0 110.28 167.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 60.4 t -137.82 121.36 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.921 1.288 . . . . 0.0 110.235 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 74.7 m -89.12 142.37 27.7 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.871 1.268 . . . . 0.0 110.929 173.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 82.3 mt -125.54 155.69 40.22 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.441 1.496 . . . . 0.0 110.511 175.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 67.0 m -68.84 -24.26 64.35 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -171.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -144.85 154.7 55.61 Favored Pre-proline 0 N--CA 1.474 0.732 0 C-N-CA 124.875 1.27 . . . . 0.0 112.503 -177.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.07 -21.47 27.43 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.109 2.539 . . . . 0.0 113.007 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.33 -40.66 97.06 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.223 -0.923 . . . . 0.0 111.376 169.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -66.42 -39.9 89.23 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.308 -0.87 . . . . 0.0 111.54 177.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 93.3 t -59.06 -47.76 88.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.449 1.1 . . . . 0.0 110.837 171.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -62.3 -39.5 93.22 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.516 0.726 . . . . 0.0 112.812 177.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.84 -46.16 97.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.757 0.823 . . . . 0.0 111.02 174.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.3 -38.58 89.93 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.117 0.872 . . . . 0.0 112.882 177.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.1 t -66.58 -37.25 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.187 0.995 . . . . 0.0 112.088 172.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -71.22 -31.0 67.04 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.23 -0.919 . . . . 0.0 113.281 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 23.9 p -91.58 -18.8 23.5 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -174.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 67.5 p -67.37 -21.61 65.61 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -61.78 -13.06 20.21 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -134.54 27.91 3.67 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.184 1.794 . . . . 0.0 112.729 174.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -54.95 150.24 10.48 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.26 1.424 . . . . 0.0 113.798 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -72.17 -37.6 69.3 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.566 1.146 . . . . 0.0 113.8 -174.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 32.8 t -164.46 -39.86 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.078 1.351 . . . . 0.0 112.149 -178.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -62.69 172.77 1.5 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.846 1.658 . . . . 0.0 112.72 169.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -142.9 149.24 38.21 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.212 1.805 . . . . 0.0 110.218 171.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 72.3 mt -133.52 140.8 45.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 125.726 1.61 . . . . 0.0 109.254 -179.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -145.31 166.16 26.34 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.388 1.875 . . . . 0.0 110.186 173.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 30.2 p -71.16 163.52 27.46 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.454 -1.404 . . . . 0.0 112.226 173.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -54.43 -41.14 69.04 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.534 -0.729 . . . . 0.0 112.117 169.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.23 -39.18 89.36 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.873 0.869 . . . . 0.0 113.264 177.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -65.13 -34.09 77.57 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.277 -0.889 . . . . 0.0 112.831 174.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 81.2 t80 . . . . . 0 CA--C 1.542 0.648 0 C-N-CA 123.393 0.677 . . . . 0.0 112.238 171.457 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.49 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 16.8 m -56.35 -16.84 6.27 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.397 1.479 . . . . 0.0 114.598 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 23.5 p -57.71 -24.15 55.4 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.565 1.946 . . . . 0.0 114.654 169.242 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 150.58 3.15 0.24 Allowed Glycine 0 CA--C 1.539 1.54 0 N-CA-C 117.458 1.743 . . . . 0.0 117.458 170.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 23.6 t -155.92 149.91 25.35 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 120.081 1.94 . . . . 0.0 113.095 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 78.1 p -119.98 -0.35 10.62 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.435 1.894 . . . . 0.0 113.626 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 108.76 -29.5 9.79 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 125.892 1.711 . . . . 0.0 114.191 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 164.74 175.07 35.16 Favored Glycine 0 CA--C 1.54 1.656 0 C-N-CA 124.695 1.141 . . . . 0.0 114.197 177.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -77.32 -9.98 17.59 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 124.29 3.326 . . . . 0.0 114.031 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -65.36 169.38 5.92 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.819 1.648 . . . . 0.0 114.2 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 90.8 mt -123.78 25.4 8.08 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.605 1.562 . . . . 0.0 112.802 -169.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -60.49 158.38 30.32 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 124.528 1.131 . . . . 0.0 112.766 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -51.4 157.15 5.02 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 124.222 3.281 . . . . 0.0 115.38 175.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -131.33 20.02 4.81 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.016 1.726 . . . . 0.0 113.813 -176.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -130.42 16.29 5.47 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 127.204 2.202 . . . . 0.0 112.755 -174.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.44 -19.04 63.09 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.575 1.15 . . . . 0.0 113.906 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -96.98 12.35 32.77 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.143 2.177 . . . . 0.0 113.528 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 45.2 t -120.55 142.56 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.248 1.419 . . . . 0.0 110.995 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 96.3 mt -113.35 163.48 14.8 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 127.201 2.201 . . . . 0.0 111.352 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -123.0 138.71 54.62 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 127.043 2.137 . . . . 0.0 107.433 167.541 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 8.1 t -133.03 137.74 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.794 1.237 . . . . 0.0 109.017 -169.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 15.8 m -127.35 135.52 50.63 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.816 1.246 . . . . 0.0 109.754 -178.036 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -158.08 158.61 30.12 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.772 1.229 . . . . 0.0 112.303 -169.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.42 148.12 34.87 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.844 3.029 . . . . 0.0 113.17 168.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -58.87 -16.16 16.07 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.737 1.755 . . . . 0.0 115.737 -176.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -82.36 -14.71 54.84 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.31 1.444 . . . . 0.0 113.948 177.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -62.62 148.72 45.41 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.129 0.877 . . . . 0.0 112.134 173.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -129.69 165.91 20.9 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.962 1.705 . . . . 0.0 111.781 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 m -50.51 -36.06 32.29 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.765 1.226 . . . . 0.0 112.42 172.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.1 m -65.89 -41.54 91.39 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 175.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -64.82 -31.61 72.92 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.737 -0.602 . . . . 0.0 111.18 173.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.62 -46.29 54.83 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.103 0.961 . . . . 0.0 111.573 177.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -58.55 -38.33 77.59 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.23 -0.919 . . . . 0.0 112.48 169.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -67.2 -39.74 86.38 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.908 0.776 . . . . 0.0 112.879 175.48 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 41.7 tp -65.54 -44.16 87.72 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.792 1.237 . . . . 0.0 111.687 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -95.36 6.9 47.79 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -175.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 8.7 t -55.18 -26.67 40.52 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.181 1.393 . . . . 0.0 113.413 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -61.06 -10.56 6.29 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.689 1.595 . . . . 0.0 114.973 174.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -122.68 8.03 9.46 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.501 1.52 . . . . 0.0 113.543 -174.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 80.8 -145.8 26.38 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 121.239 -0.913 . . . . 0.0 113.213 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -63.31 144.03 57.3 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.076 0.95 . . . . 0.0 112.401 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.9 pt -144.95 175.72 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 126.335 1.854 . . . . 0.0 111.491 -175.017 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -136.16 150.35 49.01 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.47 1.508 . . . . 0.0 109.392 168.443 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 69.0 mt -133.58 133.49 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.208 1.403 . . . . 0.0 109.227 -171.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 42.7 m -136.13 100.51 4.43 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.658 1.583 . . . . 0.0 111.196 -177.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -59.8 151.06 26.42 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 32.1 pt -135.09 -20.12 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 124.837 1.255 . . . . 0.0 113.622 169.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -152.37 -179.12 7.27 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.66 1.184 . . . . 0.0 112.104 175.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.33 -25.66 68.14 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.888 1.275 . . . . 0.0 112.719 170.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.7 p -125.29 4.13 7.78 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.949 1.699 . . . . 0.0 114.026 -169.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 93.4 p -154.58 156.16 36.05 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 172.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.84 160.18 42.1 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.954 1.702 . . . . 0.0 111.459 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -90.86 150.99 21.32 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.525 0.73 . . . . 0.0 110.108 167.726 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 68.6 t -138.66 126.6 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 124.855 1.262 . . . . 0.0 109.896 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 9.4 t -95.28 137.38 34.41 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.504 1.122 . . . . 0.0 111.253 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 71.9 mt -122.54 158.75 29.2 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.066 1.747 . . . . 0.0 110.177 177.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 99.0 p -80.67 -9.85 59.77 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -171.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -145.74 151.09 45.27 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.109 1.364 . . . . 0.0 111.915 177.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -71.57 -19.52 28.09 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.209 2.606 . . . . 0.0 113.308 172.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -65.13 -40.3 94.25 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.683 -1.261 . . . . 0.0 111.677 170.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -64.93 -39.04 92.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.734 0.814 . . . . 0.0 111.401 175.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 23.1 t -56.84 -50.71 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.368 1.067 . . . . 0.0 111.173 170.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -60.48 -41.69 94.73 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.391 0.541 . . . . 0.0 112.311 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 81.1 mt -62.62 -47.11 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.862 0.865 . . . . 0.0 111.28 175.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.55 -40.71 97.68 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 119.232 0.923 . . . . 0.0 112.874 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 77.9 t -66.97 -34.01 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.184 0.994 . . . . 0.0 112.172 175.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -70.28 -46.43 64.37 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.114 -0.991 . . . . 0.0 112.221 173.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 24.0 p -73.81 -25.22 59.99 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -174.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 53.7 p -66.4 -19.71 65.87 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -57.39 -22.38 42.46 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.813 1.245 . . . . 0.0 113.746 174.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -98.5 -5.62 31.88 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.198 1.399 . . . . 0.0 113.42 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -77.17 145.5 37.64 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.482 1.113 . . . . 0.0 112.562 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -129.76 0.46 4.87 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.908 1.283 . . . . 0.0 114.286 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 46.6 m -126.61 0.86 6.84 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.809 1.644 . . . . 0.0 112.986 177.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -161.22 171.63 18.1 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.524 2.33 . . . . 0.0 109.741 175.71 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 18.3 tpp85 -148.64 155.13 40.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.855 1.262 . . . . 0.0 111.127 169.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 73.9 mt -134.66 141.59 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.052 1.741 . . . . 0.0 109.387 -173.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -145.96 168.68 20.28 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.259 1.824 . . . . 0.0 110.557 172.237 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 30.4 p -71.62 163.03 28.52 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 120.662 -1.274 . . . . 0.0 112.347 173.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -57.21 -40.8 78.18 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.263 -0.898 . . . . 0.0 111.733 169.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.73 85.12 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.763 0.825 . . . . 0.0 113.03 177.704 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.38 -42.31 96.21 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.235 -0.916 . . . . 0.0 112.212 171.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -59.18 -46.55 88.12 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.03 0.832 . . . . 0.0 111.989 174.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 34.7 t -58.78 -44.75 90.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.546 1.138 . . . . 0.0 112.033 173.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -70.87 -9.07 65.37 Favored Glycine 0 CA--C 1.539 1.579 0 C-N-CA 124.372 0.987 . . . . 0.0 115.007 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -117.69 8.5 12.8 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 127.113 2.165 . . . . 0.0 112.829 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -53.58 -27.78 28.36 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.703 2.001 . . . . 0.0 114.23 -177.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 8.0 pm0 -70.62 47.38 0.1 Allowed 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 127.49 2.316 . . . . 0.0 113.169 169.009 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -48.96 -38.45 23.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 127.582 2.353 . . . . 0.0 115.935 -168.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 53.8 41.26 66.29 Favored Glycine 0 CA--C 1.538 1.514 0 C-N-CA 124.468 1.032 . . . . 0.0 114.144 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -49.69 -40.33 39.85 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 126.568 1.947 . . . . 0.0 115.148 -169.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -140.14 157.48 45.56 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.105 1.362 . . . . 0.0 111.735 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 6.7 p -131.76 1.55 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.027 1.331 . . . . 0.0 113.948 -169.56 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -56.9 -35.47 69.01 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.649 1.18 . . . . 0.0 112.91 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 69.4 m -145.05 -39.62 0.25 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.535 1.934 . . . . 0.0 111.227 169.616 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 156.02 175.92 27.56 Favored Glycine 0 CA--C 1.538 1.514 0 C-N-CA 125.793 1.663 . . . . 0.0 112.685 173.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.8 -20.29 58.76 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.435 2.756 . . . . 0.0 113.198 176.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 19.8 m -66.9 -8.94 32.87 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.423 1.489 . . . . 0.0 114.261 170.282 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 19.6 m -132.6 8.59 4.22 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.762 1.625 . . . . 0.0 113.515 -171.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 C-N-CA 125.323 1.44 . . . . 0.0 112.713 -178.625 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.914 0 C5'-C4'-O4' 112.767 2.548 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.491 0 N-CA-C 111.76 -0.536 . . . . 0.0 111.76 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 17.3 t -152.95 162.43 41.33 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.228 1.411 . . . . 0.0 111.725 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 28.7 m -69.19 -10.0 55.63 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.538 1.535 . . . . 0.0 114.575 178.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -170.18 -176.8 40.0 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.004 1.287 . . . . 0.0 113.797 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 79.2 p -136.99 10.08 3.05 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.407 1.483 . . . . 0.0 114.245 -173.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 8.5 t -149.32 173.06 13.92 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.032 1.733 . . . . 0.0 111.079 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -169.01 178.51 42.24 Favored Glycine 0 CA--C 1.535 1.292 0 C-N-CA 124.134 0.873 . . . . 0.0 114.937 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 171.64 -165.75 38.67 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 125.692 1.615 . . . . 0.0 112.115 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -72.06 -15.13 29.15 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.959 2.44 . . . . 0.0 113.703 175.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -79.62 -2.56 43.16 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 -171.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.1 9.73 26.17 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.303 1.441 . . . . 0.0 114.461 -176.65 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -58.72 148.07 68.98 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 124.101 0.961 . . . . 0.0 112.356 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -77.21 -7.33 17.08 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.653 2.902 . . . . 0.0 114.59 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -58.99 152.09 20.55 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.9 mmt-85 -138.8 11.77 2.68 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.895 2.078 . . . . 0.0 112.927 176.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -58.74 -19.54 41.23 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.161 1.384 . . . . 0.0 113.731 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -115.34 16.61 16.76 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.588 2.355 . . . . 0.0 112.904 -175.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 42.9 t -123.1 138.47 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.677 1.191 . . . . 0.0 112.165 -170.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 76.8 mt -118.22 164.3 15.38 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 127.191 2.196 . . . . 0.0 110.839 175.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -118.09 141.96 47.92 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.802 2.041 . . . . 0.0 107.908 167.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.7 t -133.16 139.25 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.556 1.542 . . . . 0.0 109.107 -171.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.5 m -128.14 134.87 49.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.346 1.458 . . . . 0.0 109.594 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -158.32 158.58 29.85 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.715 1.206 . . . . 0.0 111.539 -170.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -66.17 151.16 84.31 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.061 1.841 . . . . 0.0 111.065 169.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -60.65 -11.72 8.14 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -66.68 -19.81 65.84 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.47 1.108 . . . . 0.0 113.522 171.297 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -73.61 153.31 40.24 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.285 1.034 . . . . 0.0 112.758 175.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 173.46 11.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.6 1.96 . . . . 0.0 111.691 175.456 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 m -49.12 -35.77 17.25 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.197 1.399 . . . . 0.0 112.395 171.538 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.7 m -64.5 -43.31 94.51 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 176.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -65.92 -31.61 72.64 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.653 -0.654 . . . . 0.0 111.187 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.0 mt -71.44 -43.7 66.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.868 0.867 . . . . 0.0 111.502 175.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -58.68 -42.43 88.51 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.943 -1.098 . . . . 0.0 111.753 169.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -62.81 -33.82 76.02 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 119.035 0.834 . . . . 0.0 112.971 176.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.2 tp -73.37 -29.93 62.95 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.789 1.236 . . . . 0.0 113.369 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -121.06 -0.2 10.06 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -169.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 78.0 p -56.88 -23.91 48.03 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 176.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -57.71 -17.07 13.03 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.469 1.508 . . . . 0.0 114.545 174.378 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -99.56 3.71 45.54 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.218 1.407 . . . . 0.0 113.99 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.67 -44.1 3.04 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.955 1.741 . . . . 0.0 115.817 168.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -150.16 133.84 16.7 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.878 1.271 . . . . 0.0 110.594 177.481 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.9 pt -146.1 173.25 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.018 1.327 . . . . 0.0 112.101 -172.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 62.8 tp60 -139.92 139.1 36.1 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.002 1.321 . . . . 0.0 108.817 167.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 71.8 mt -112.94 132.36 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.11 1.364 . . . . 0.0 108.279 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 57.9 m -141.03 95.97 2.93 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.258 1.423 . . . . 0.0 111.095 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -57.97 152.68 15.81 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -177.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 37.7 pt -134.26 -19.8 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 125.21 1.404 . . . . 0.0 113.398 169.185 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -153.64 178.27 10.04 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.733 1.213 . . . . 0.0 111.994 174.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -63.61 -17.42 62.86 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.36 1.864 . . . . 0.0 112.733 171.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.2 p -135.07 7.59 3.42 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 127.197 2.199 . . . . 0.0 113.64 -171.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 4.0 m -149.66 146.37 27.23 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.21 1.004 . . . . 0.0 113.693 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.44 158.98 43.4 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.189 1.395 . . . . 0.0 112.04 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -90.38 152.75 20.86 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.75 0.82 . . . . 0.0 109.726 167.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.0 t -136.11 115.05 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 C-N-CA 124.231 1.012 . . . . 0.0 110.42 173.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 24.0 m -79.21 143.36 35.42 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.248 1.419 . . . . 0.0 109.831 169.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 76.7 mt -119.7 161.6 20.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.938 1.295 . . . . 0.0 111.092 175.838 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 21.1 t -60.32 -34.84 74.39 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.627 1.171 . . . . 0.0 113.673 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -140.32 151.53 64.55 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 125.179 1.392 . . . . 0.0 111.684 -177.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -69.21 -23.71 32.99 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.129 2.553 . . . . 0.0 113.868 -178.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.72 -33.64 75.53 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 120.863 -1.148 . . . . 0.0 112.387 173.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -66.1 -27.71 68.26 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.284 1.033 . . . . 0.0 112.785 -179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 90.0 t -61.93 -46.56 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.776 1.23 . . . . 0.0 110.617 173.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -63.53 -41.25 98.48 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.642 0.777 . . . . 0.0 111.699 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.32 -51.32 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.652 0.781 . . . . 0.0 110.528 175.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.89 90.88 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.8 t -62.77 -36.72 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 O-C-N 121.025 -1.047 . . . . 0.0 111.754 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -73.11 -30.57 63.74 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -91.48 -33.06 15.35 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -176.604 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 90.0 p -70.08 -17.75 63.24 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 50.7 pttt -59.93 -12.07 7.0 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.162 1.541 . . . . 0.0 115.162 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -101.01 1.31 39.44 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.898 1.679 . . . . 0.0 113.968 178.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -61.85 159.26 14.2 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.63 1.172 . . . . 0.0 113.958 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.82 -1.93 2.18 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.033 1.333 . . . . 0.0 114.57 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 78.2 p -140.81 1.48 1.69 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.446 1.498 . . . . 0.0 114.172 -176.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -156.75 175.43 14.07 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.038 2.135 . . . . 0.0 109.983 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 76.6 ttt-85 -145.85 150.89 36.98 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.351 1.46 . . . . 0.0 110.895 172.479 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 85.0 mt -131.88 144.93 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 126.18 1.792 . . . . 0.0 109.577 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -150.27 169.27 21.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.735 1.614 . . . . 0.0 110.747 169.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 59.9 p -71.06 162.63 29.1 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 120.815 -1.178 . . . . 0.0 112.229 174.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -58.13 -37.57 74.86 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 121.386 -0.821 . . . . 0.0 112.085 169.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.71 -38.39 89.05 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.76 0.824 . . . . 0.0 113.0 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -67.66 -39.18 84.56 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.117 -0.989 . . . . 0.0 112.545 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -57.95 -47.04 84.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.775 0.83 . . . . 0.0 111.737 172.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 27.2 t -58.97 -43.43 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.639 1.176 . . . . 0.0 112.172 171.497 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -63.82 -25.4 69.11 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 124.643 1.115 . . . . 0.0 115.298 -172.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -81.72 -45.21 16.0 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.9 1.35 . . . . 0.0 111.808 168.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -60.21 -31.08 69.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.409 1.484 . . . . 0.0 114.793 -172.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -59.71 -18.77 45.26 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 175.589 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -100.11 -13.8 18.83 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.522 1.529 . . . . 0.0 113.235 176.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -84.46 52.71 4.74 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 126.077 1.799 . . . . 0.0 114.238 -175.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -140.81 154.09 46.09 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.613 1.565 . . . . 0.0 111.937 -174.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -144.83 174.14 11.25 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.94 1.696 . . . . 0.0 112.002 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.8 m -127.44 18.04 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 125.461 1.504 . . . . 0.0 113.2 -172.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -141.86 169.89 16.75 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.317 1.847 . . . . 0.0 112.391 -178.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 8.0 t -144.92 -177.59 5.6 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.607 1.563 . . . . 0.0 112.028 -176.137 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -126.72 67.67 0.54 Allowed Glycine 0 CA--C 1.537 1.447 0 C-N-CA 126.54 2.019 . . . . 0.0 112.906 -175.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -67.14 -10.92 30.29 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.905 3.07 . . . . 0.0 114.569 -175.67 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 45.6 p -68.3 -20.24 64.75 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.204 1.402 . . . . 0.0 114.248 172.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 71.5 m -65.89 153.42 42.06 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.494 1.117 . . . . 0.0 112.987 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.268 0 C-N-CA 125.152 1.358 . . . . 0.0 112.825 178.251 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.766 0 C5'-C4'-O4' 113.112 2.794 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.538 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 23.3 m 52.3 29.08 6.29 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 125.558 1.543 . . . . 0.0 114.035 -173.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.7 m -62.83 -20.78 65.39 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.068 1.747 . . . . 0.0 115.381 -169.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -68.94 -27.25 74.06 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 124.066 0.841 . . . . 0.0 114.218 177.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 49.0 m -66.42 -21.53 66.21 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 43.0 m -64.59 -12.81 49.23 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -131.51 8.74 5.58 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.776 1.179 . . . . 0.0 115.269 -178.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 39.21 54.54 2.55 Favored Glycine 0 CA--C 1.546 1.995 0 C-N-CA 126.249 1.88 . . . . 0.0 116.817 178.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -66.68 166.49 22.03 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.597 2.865 . . . . 0.0 113.171 -177.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -140.7 174.7 10.26 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.889 1.276 . . . . 0.0 113.761 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.09 4.63 33.23 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 -171.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -58.46 131.44 85.05 Favored Pre-proline 0 CA--C 1.55 0.973 0 CA-C-N 119.484 1.038 . . . . 0.0 112.188 -175.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -78.47 -7.12 15.82 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.662 2.908 . . . . 0.0 114.306 -176.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -138.36 156.68 47.38 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.191 1.796 . . . . 0.0 111.271 -174.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -135.99 8.82 3.26 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 126.053 1.741 . . . . 0.0 113.1 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -63.53 -23.85 67.56 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.569 1.147 . . . . 0.0 113.442 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -93.71 17.57 11.65 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 127.502 2.321 . . . . 0.0 113.584 176.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 24.6 t -126.52 135.88 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.813 1.245 . . . . 0.0 111.399 -170.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 89.7 mt -103.11 167.0 10.11 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.693 1.997 . . . . 0.0 111.8 174.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -122.95 135.69 54.58 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 127.376 2.27 . . . . 0.0 107.224 167.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.4 t -131.35 140.16 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.797 1.239 . . . . 0.0 109.084 -171.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 9.9 m -131.18 136.62 48.45 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.041 1.336 . . . . 0.0 109.76 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -158.91 158.74 29.34 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.477 1.111 . . . . 0.0 112.415 -169.708 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -53.79 148.72 35.89 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.79 2.993 . . . . 0.0 113.281 169.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -61.11 -9.33 4.44 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -85.02 -12.23 53.62 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.333 1.453 . . . . 0.0 113.931 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 7.9 m95 -63.61 157.7 23.17 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -131.52 162.93 29.11 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.577 1.951 . . . . 0.0 111.651 -178.369 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.6 m -52.74 -35.95 56.96 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.763 1.225 . . . . 0.0 111.999 169.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.2 m -66.37 -41.52 89.34 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.496 0.925 . . . . 0.0 113.496 176.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -65.28 -30.68 71.57 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.792 -0.567 . . . . 0.0 111.393 173.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 62.0 mt -70.71 -47.31 60.45 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.867 0.867 . . . . 0.0 111.479 175.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -58.41 -38.93 78.4 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.99 -1.069 . . . . 0.0 112.452 170.441 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -65.91 -39.34 90.5 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.072 0.851 . . . . 0.0 112.844 175.438 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.38 -33.84 75.53 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.243 1.417 . . . . 0.0 112.11 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -110.85 9.8 22.47 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.711 1.374 . . . . 0.0 114.711 -174.385 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 32.8 m -57.97 -22.06 47.38 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 121.03 -1.044 . . . . 0.0 113.771 173.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.08 -15.23 12.8 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.435 1.494 . . . . 0.0 114.685 171.218 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -113.33 4.01 16.19 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.587 1.555 . . . . 0.0 113.627 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.68 -44.95 2.82 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 126.0 1.762 . . . . 0.0 115.242 172.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -153.3 144.38 22.97 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.826 1.25 . . . . 0.0 111.894 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 15.4 pt -145.35 176.03 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 126.349 1.86 . . . . 0.0 111.611 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -136.85 145.23 44.17 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.944 1.298 . . . . 0.0 109.415 168.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 76.2 mt -123.51 134.51 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.438 1.095 . . . . 0.0 110.051 -169.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.4 m -134.33 96.89 3.69 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 126.216 1.806 . . . . 0.0 109.966 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -55.83 155.8 5.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.475 1.11 . . . . 0.0 113.88 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 12.7 mt -128.49 -39.07 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.967 1.307 . . . . 0.0 109.959 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -153.67 -172.4 4.22 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.71 1.604 . . . . 0.0 110.52 174.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -63.93 -17.75 63.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.687 1.195 . . . . 0.0 113.073 172.254 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.9 p -127.41 2.87 6.28 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 126.433 1.893 . . . . 0.0 114.332 -169.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 80.1 p -153.73 153.92 33.11 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.94 151.73 31.6 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.45 1.5 . . . . 0.0 111.86 -179.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -89.59 145.87 24.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.936 0.894 . . . . 0.0 108.86 167.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.4 t -137.88 111.26 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.86 0.864 . . . . 0.0 110.984 -176.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 66.5 m -75.87 138.31 41.0 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.917 1.687 . . . . 0.0 110.955 171.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 49.5 mt -112.61 163.39 14.58 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.303 1.041 . . . . 0.0 112.199 178.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 17.6 t -64.37 -34.04 77.25 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.252 1.021 . . . . 0.0 113.318 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -141.11 149.49 55.69 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.333 1.453 . . . . 0.0 111.21 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.44 -24.65 26.32 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.95 2.433 . . . . 0.0 113.991 -177.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.52 -27.03 68.17 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.754 -1.216 . . . . 0.0 113.39 174.411 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -67.43 -26.14 66.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.434 1.094 . . . . 0.0 112.272 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.5 t -61.78 -45.38 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.936 1.294 . . . . 0.0 110.257 176.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.25 -39.63 92.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.79 0.836 . . . . 0.0 111.825 177.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 99.3 mt -60.96 -49.67 83.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 123.91 0.884 . . . . 0.0 110.573 175.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.15 93.42 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 74.8 t -63.66 -40.62 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.427 -0.795 . . . . 0.0 110.961 173.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -64.05 -45.13 90.17 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.889 0.768 . . . . 0.0 112.836 175.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -72.9 -27.5 61.92 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -176.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 31.7 p -62.77 -19.76 64.31 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -60.07 -12.6 8.64 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.245 1.418 . . . . 0.0 114.011 171.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -121.0 12.09 11.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.009 1.723 . . . . 0.0 112.699 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.72 164.37 10.0 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.661 1.185 . . . . 0.0 113.061 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -132.98 -13.37 2.81 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.141 1.376 . . . . 0.0 113.085 178.179 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 71.1 p -145.84 7.71 1.09 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.114 1.365 . . . . 0.0 114.682 -170.448 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -157.72 175.06 14.39 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.978 1.711 . . . . 0.0 111.418 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 -146.4 149.66 34.18 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.219 1.808 . . . . 0.0 110.507 172.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 88.0 mt -133.87 145.67 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.853 1.661 . . . . 0.0 109.605 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.2 pt20 -149.73 170.43 18.74 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.128 1.771 . . . . 0.0 110.36 169.615 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 25.4 p -72.08 164.51 26.03 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.536 -1.352 . . . . 0.0 112.191 173.028 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -55.34 -41.79 72.96 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.273 -0.892 . . . . 0.0 111.934 169.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -69.38 -38.13 77.89 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.859 0.864 . . . . 0.0 113.213 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -61.44 -41.31 97.0 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.841 0.856 . . . . 0.0 111.962 173.649 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -61.0 -52.19 66.06 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.383 0.538 . . . . 0.0 111.843 172.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 25.0 t -54.81 -44.15 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 124.216 1.007 . . . . 0.0 112.312 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -69.94 -9.14 62.46 Favored Glycine 0 CA--C 1.54 1.611 0 C-N-CA 124.348 0.975 . . . . 0.0 115.243 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -114.52 -12.69 12.26 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.241 1.816 . . . . 0.0 113.055 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -58.53 -39.38 79.99 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.52 1.928 . . . . 0.0 113.692 -175.435 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -145.98 -48.81 0.21 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.85 1.26 . . . . 0.0 112.958 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -157.05 169.54 24.58 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.005 1.322 . . . . 0.0 113.004 -172.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -168.16 177.46 42.29 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.466 1.508 . . . . 0.0 113.237 176.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -66.36 167.14 11.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.289 1.436 . . . . 0.0 113.239 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -134.26 155.35 50.33 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.864 1.666 . . . . 0.0 111.346 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.9 m -73.32 -16.89 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 -173.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -150.62 149.73 30.24 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.352 1.461 . . . . 0.0 111.589 -176.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 70.9 m -142.15 166.13 25.55 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.642 1.977 . . . . 0.0 111.007 175.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -175.49 171.92 44.98 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 124.431 1.015 . . . . 0.0 113.697 176.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -75.65 -20.67 15.39 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.701 2.934 . . . . 0.0 114.0 -176.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 86.6 p -157.25 169.36 24.94 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.638 1.575 . . . . 0.0 112.103 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 43.3 m -132.98 9.3 4.14 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.203 1.401 . . . . 0.0 113.826 -177.414 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.186 0 C-N-CA 125.382 1.467 . . . . 0.0 112.714 -178.748 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 O5'-C5'-C4' 113.77 2.55 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.534 0 N-CA-C 111.716 -0.554 . . . . 0.0 111.716 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 22.6 m -132.85 8.36 4.12 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 17.9 t -60.01 -31.92 70.39 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.644 1.177 . . . . 0.0 113.249 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -64.22 -10.51 41.64 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 124.971 1.272 . . . . 0.0 115.133 172.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 45.7 m -129.22 19.1 5.91 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.843 2.057 . . . . 0.0 111.799 177.433 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 25.5 m 52.25 21.21 1.57 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.885 2.074 . . . . 0.0 115.291 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 69.06 2.24 30.38 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 125.037 1.303 . . . . 0.0 115.698 -174.158 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 154.82 177.84 28.54 Favored Glycine 0 CA--C 1.542 1.752 0 CA-C-N 119.09 1.445 . . . . 0.0 114.152 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.38 173.76 11.05 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 124.143 3.228 . . . . 0.0 113.107 177.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -70.98 1.78 5.21 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.974 1.709 . . . . 0.0 115.59 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.7 pp -143.68 176.49 9.18 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.379 1.872 . . . . 0.0 112.21 -178.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 25.2 pt20 -147.71 140.22 14.54 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 124.536 1.134 . . . . 0.0 111.684 177.353 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -59.64 -34.38 96.48 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 123.539 2.826 . . . . 0.0 116.139 -176.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -141.35 173.09 11.82 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.101 1.76 . . . . 0.0 112.321 -169.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -130.35 14.48 5.57 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 126.813 2.045 . . . . 0.0 113.377 -174.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -60.34 -14.21 17.24 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.395 1.478 . . . . 0.0 114.524 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 46.3 p-80 -117.3 18.05 14.54 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 128.154 2.582 . . . . 0.0 112.44 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 26.6 t -123.92 143.75 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.239 1.416 . . . . 0.0 111.267 -174.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 70.8 mt -121.88 166.54 14.25 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.462 2.305 . . . . 0.0 110.672 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -125.21 142.82 51.27 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 126.641 1.977 . . . . 0.0 108.395 168.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -135.64 142.46 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.836 1.254 . . . . 0.0 109.558 -169.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 2.0 m -129.65 137.4 50.64 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.119 1.368 . . . . 0.0 109.796 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -159.36 157.3 27.01 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 124.413 1.085 . . . . 0.0 112.371 -169.155 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.52 143.85 65.65 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.721 2.947 . . . . 0.0 112.75 169.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -55.61 -25.38 38.38 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.073 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -65.95 -13.41 59.72 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.562 1.545 . . . . 0.0 114.356 177.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -69.14 156.37 38.8 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.321 1.048 . . . . 0.0 112.784 172.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -128.99 171.17 12.61 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.538 1.935 . . . . 0.0 110.969 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.0 m -52.41 -32.55 39.58 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.025 1.33 . . . . 0.0 111.757 169.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.3 m -64.46 -43.23 94.88 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 173.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -66.48 -30.99 71.44 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.572 -0.705 . . . . 0.0 111.277 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 74.9 mt -70.15 -43.77 70.19 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.639 0.776 . . . . 0.0 111.408 173.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -58.5 -39.91 81.35 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 120.854 -1.154 . . . . 0.0 112.196 169.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -65.83 -34.51 78.31 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 119.126 0.875 . . . . 0.0 113.038 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 58.3 tp -70.64 -31.03 67.83 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.595 1.158 . . . . 0.0 113.056 176.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -117.22 6.03 12.74 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -171.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 78.2 p -57.67 -25.29 60.02 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 178.004 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.16 -15.65 15.82 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.549 1.54 . . . . 0.0 114.662 176.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -101.8 3.07 39.04 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.108 1.363 . . . . 0.0 114.069 -176.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.89 -48.72 4.1 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.906 1.717 . . . . 0.0 114.998 169.48 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -152.13 140.18 20.2 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.805 1.242 . . . . 0.0 111.113 176.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 30.5 pt -146.0 174.94 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.925 1.69 . . . . 0.0 111.842 -171.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 8.0 tm0? -139.91 139.54 36.22 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.978 1.311 . . . . 0.0 108.612 169.153 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 72.5 mt -120.84 130.07 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.879 1.272 . . . . 0.0 109.448 -175.029 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.3 m -134.78 99.61 4.37 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.335 1.454 . . . . 0.0 111.335 -176.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -57.4 152.26 14.74 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.768 1.227 . . . . 0.0 113.666 175.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 19.6 pt -134.15 -25.86 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.77 1.228 . . . . 0.0 113.173 169.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -156.0 179.32 9.33 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.048 1.339 . . . . 0.0 112.114 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.88 -14.09 60.84 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 -175.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 50.1 p -132.46 6.44 4.11 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.295 1.438 . . . . 0.0 113.603 -177.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 1.1 p -150.92 152.15 33.2 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 173.17 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -155.34 159.45 39.95 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.372 1.469 . . . . 0.0 111.87 -174.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.87 152.48 21.23 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.426 0.69 . . . . 0.0 110.769 168.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 59.6 t -137.21 116.25 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.954 1.301 . . . . 0.0 109.748 174.645 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 8.4 t -85.08 140.85 30.67 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.961 1.304 . . . . 0.0 110.53 172.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 60.9 mt -117.77 165.05 14.1 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.235 1.414 . . . . 0.0 111.548 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 9.4 t -62.97 -32.38 73.7 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.399 1.08 . . . . 0.0 113.864 -173.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -152.67 157.34 33.44 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.193 0.997 . . . . 0.0 112.919 175.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.13 -33.24 63.1 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.393 3.395 . . . . 0.0 115.517 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -58.21 -35.65 71.96 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -70.0 -23.4 63.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.405 1.082 . . . . 0.0 113.262 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 99.0 t -59.48 -44.22 92.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.155 1.382 . . . . 0.0 111.094 177.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -66.57 -34.95 79.05 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.594 0.758 . . . . 0.0 112.061 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 59.8 mt -64.96 -48.15 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.696 0.798 . . . . 0.0 110.212 176.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.95 -38.51 91.34 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.3 t -63.97 -40.22 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 121.31 -0.869 . . . . 0.0 111.361 173.126 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -61.09 -49.92 75.34 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.03 0.832 . . . . 0.0 112.201 172.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.0 p -67.3 -27.01 66.82 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -174.693 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 9.4 t -64.27 -19.7 65.57 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 171.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -60.78 -18.82 57.42 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.519 1.128 . . . . 0.0 113.147 172.497 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -117.33 7.69 12.92 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.858 1.663 . . . . 0.0 112.762 -175.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.22 156.97 30.14 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.27 1.428 . . . . 0.0 113.392 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -134.23 -12.26 2.47 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.773 1.229 . . . . 0.0 114.058 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 38.3 m -139.13 6.89 2.4 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.08 1.352 . . . . 0.0 113.744 -173.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -158.65 176.01 12.92 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.042 1.737 . . . . 0.0 111.31 -176.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . 0.446 HH22 ' NE2' ' A' ' 500' ' ' GLN . 50.1 ttp85 -147.27 145.79 29.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.581 1.952 . . . . 0.0 110.098 174.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 69.5 mt -130.77 141.97 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.738 1.615 . . . . 0.0 109.629 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . 0.446 ' NE2' HH22 ' A' ' 498' ' ' ARG . 24.0 pt20 -145.1 166.59 24.96 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.825 1.65 . . . . 0.0 110.924 171.124 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 52.0 p -71.72 163.24 28.15 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 120.756 -1.215 . . . . 0.0 112.378 174.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -58.69 -37.01 75.13 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.187 -0.946 . . . . 0.0 112.063 170.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.71 95.95 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.333 -0.854 . . . . 0.0 112.809 174.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -65.35 -32.68 74.45 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.348 -0.845 . . . . 0.0 112.977 173.375 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -66.46 -50.85 61.93 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.119 0.872 . . . . 0.0 111.427 169.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 16.4 t -53.49 -44.08 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.727 1.211 . . . . 0.0 112.046 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -67.87 -5.86 41.46 Favored Glycine 0 CA--C 1.539 1.592 0 C-N-CA 124.819 1.199 . . . . 0.0 115.596 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -115.23 -31.07 6.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.797 1.639 . . . . 0.0 112.314 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -60.2 -33.65 72.53 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.463 1.905 . . . . 0.0 112.639 169.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -134.35 133.31 40.5 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.628 1.571 . . . . 0.0 110.104 173.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -136.99 19.71 3.01 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 125.888 1.675 . . . . 0.0 113.044 -173.516 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -165.75 175.46 41.4 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.175 1.369 . . . . 0.0 113.607 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -146.63 -35.2 0.27 Allowed 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -173.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 37.7 tp60 -77.41 29.66 0.15 Allowed 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.549 1.539 . . . . 0.0 114.151 -174.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 34.4 m -64.43 -20.45 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 O-C-N 120.395 -1.44 . . . . 0.0 114.241 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -149.32 94.19 2.18 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.021 1.728 . . . . 0.0 110.394 177.468 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 65.1 m -62.32 161.61 11.21 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.26 1.024 . . . . 0.0 112.814 173.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -178.77 -167.16 36.0 Favored Glycine 0 CA--C 1.54 1.595 0 C-N-CA 124.977 1.275 . . . . 0.0 112.624 -176.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.39 -19.42 68.08 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 123.343 2.695 . . . . 0.0 113.405 178.495 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 34.6 p -64.81 -8.98 17.26 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.884 1.674 . . . . 0.0 114.387 169.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 19.3 m -126.13 9.51 7.4 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.303 1.841 . . . . 0.0 113.271 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.25 0 CA-C-O 118.288 -1.284 . . . . 0.0 113.135 -179.281 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.363 0 O5'-C5'-C4' 113.656 2.469 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 23.2 t -153.55 -40.17 0.1 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.474 1.11 . . . . 0.0 113.013 177.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 84.3 p -152.11 167.42 28.56 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.369 1.467 . . . . 0.0 112.196 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -167.33 24.26 0.12 Allowed Glycine 0 CA--C 1.537 1.449 0 N-CA-C 115.354 0.902 . . . . 0.0 115.354 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 36.9 t -154.95 152.21 29.44 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.098 1.359 . . . . 0.0 111.599 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 59.8 p -71.59 -22.57 61.71 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.901 1.28 . . . . 0.0 113.345 169.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 73.92 2.79 62.36 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 125.194 1.378 . . . . 0.0 115.522 -178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 152.1 -168.37 31.32 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 125.164 1.364 . . . . 0.0 112.838 -175.655 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -64.78 -24.06 62.06 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 122.948 2.432 . . . . 0.0 112.532 169.663 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -151.04 -169.75 3.47 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.953 2.501 . . . . 0.0 108.861 168.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.3 pp -58.9 -3.94 0.4 Allowed 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 116.963 2.209 . . . . 0.0 116.963 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -131.74 117.42 16.31 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 127.019 2.128 . . . . 0.0 109.517 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.68 12.3 0.93 Allowed 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 124.494 3.463 . . . . 0.0 116.76 -171.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -57.74 -6.14 0.48 Allowed 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 -130.47 14.56 5.51 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.706 1.602 . . . . 0.0 113.874 169.728 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.64 -15.42 63.64 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.649 -1.282 . . . . 0.0 113.578 176.327 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 -88.19 8.0 29.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.401 1.881 . . . . 0.0 114.08 172.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 40.7 t -110.86 148.58 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.092 1.357 . . . . 0.0 110.903 -173.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 94.5 mt -122.69 164.24 18.63 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.186 2.594 . . . . 0.0 110.522 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -126.75 139.12 53.37 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.461 1.905 . . . . 0.0 107.679 168.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.4 t -132.85 141.83 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.975 1.31 . . . . 0.0 109.226 -169.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.6 m -132.88 135.15 45.42 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.881 1.272 . . . . 0.0 109.753 -177.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -159.85 162.55 24.51 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 124.994 1.318 . . . . 0.0 111.719 -168.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.44 149.14 90.55 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.215 1.943 . . . . 0.0 110.909 168.733 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -18.54 13.71 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -57.34 -26.26 60.69 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.052 1.741 . . . . 0.0 113.979 173.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 19.7 m95 -64.65 154.4 36.56 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.001 0.921 . . . . 0.0 113.087 175.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -132.17 164.99 25.1 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.597 1.959 . . . . 0.0 111.129 177.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.9 m -53.29 -34.75 58.61 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.743 1.217 . . . . 0.0 112.156 173.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.2 m -65.36 -43.35 91.11 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.734 1.012 . . . . 0.0 113.734 175.137 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -64.81 -31.64 72.96 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.675 -0.64 . . . . 0.0 111.309 174.35 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.2 mt -71.05 -44.99 64.66 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.031 0.932 . . . . 0.0 111.551 175.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -57.22 -42.54 81.57 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.009 -1.057 . . . . 0.0 112.109 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -68.26 -29.07 67.79 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.458 1.103 . . . . 0.0 113.935 177.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.6 tp -69.5 -36.49 76.52 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.334 1.054 . . . . 0.0 112.316 173.547 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -110.96 -2.61 15.92 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -170.515 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 79.0 p -58.09 -19.66 33.8 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 176.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -57.41 -18.93 20.36 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.084 1.354 . . . . 0.0 114.133 170.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -100.18 2.71 43.2 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.743 1.617 . . . . 0.0 113.612 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 96.27 -159.67 21.97 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.011 1.291 . . . . 0.0 111.891 -171.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -64.24 150.37 46.06 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 121.838 -0.801 . . . . 0.0 111.25 169.203 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 5.5 pt -143.53 179.76 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 125.338 1.455 . . . . 0.0 111.655 -174.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -128.15 151.9 48.66 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.537 1.535 . . . . 0.0 110.699 170.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 60.3 mt -139.4 134.35 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.919 1.688 . . . . 0.0 108.972 -172.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.9 m -139.35 102.2 4.43 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.991 1.316 . . . . 0.0 111.384 -177.45 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -59.28 153.15 19.28 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 29.5 pt -134.9 -23.93 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.831 1.252 . . . . 0.0 113.416 169.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -153.7 174.38 14.59 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.353 1.061 . . . . 0.0 111.947 174.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -60.88 -15.09 26.82 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.601 1.96 . . . . 0.0 113.898 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 37.2 p -135.91 6.24 3.14 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.001 2.12 . . . . 0.0 113.448 -174.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 66.5 m -147.38 140.29 25.0 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.394 1.078 . . . . 0.0 113.218 -174.281 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.45 158.7 42.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.529 1.131 . . . . 0.0 112.49 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -89.04 153.29 21.12 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.753 0.821 . . . . 0.0 110.006 167.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 73.4 t -136.3 140.53 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.92 1.288 . . . . 0.0 109.091 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 43.0 m -124.97 116.09 21.61 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.206 1.403 . . . . 0.0 110.083 -169.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 47.1 mt -102.94 166.32 10.52 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.202 1.401 . . . . 0.0 111.176 -175.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 50.8 m -69.84 -26.75 64.37 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 -175.279 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -148.22 148.85 30.54 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 124.497 1.119 . . . . 0.0 112.348 -177.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -57.18 -26.02 67.37 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 123.5 2.8 . . . . 0.0 114.124 168.549 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -61.04 -33.54 73.46 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.064 -1.023 . . . . 0.0 112.56 172.25 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -76.46 -34.31 58.7 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.845 0.858 . . . . 0.0 111.799 174.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 22.4 t -57.54 -44.69 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.065 0.946 . . . . 0.0 111.354 170.292 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -58.97 -41.04 86.58 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.133 0.573 . . . . 0.0 112.378 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 91.0 mt -66.87 -45.76 86.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.634 0.773 . . . . 0.0 110.938 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.1 -34.32 76.1 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 119.324 0.965 . . . . 0.0 113.466 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 60.4 t -65.73 -43.84 93.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 O-C-N 121.296 -0.878 . . . . 0.0 111.003 170.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -60.5 -45.06 95.16 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.922 0.783 . . . . 0.0 112.729 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 46.0 p -71.64 -27.4 63.06 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -177.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 24.8 p -63.21 -19.05 64.17 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 59.1 mtmt -60.96 -18.38 56.95 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.254 1.422 . . . . 0.0 113.963 173.452 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -119.06 1.4 11.41 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.064 1.345 . . . . 0.0 113.211 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -68.19 152.78 44.96 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.669 1.188 . . . . 0.0 112.469 173.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -132.27 -4.9 3.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.818 1.247 . . . . 0.0 114.044 -177.564 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 22.6 m -136.52 5.9 2.96 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.322 1.449 . . . . 0.0 113.413 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -161.04 171.52 18.47 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.039 2.135 . . . . 0.0 110.173 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -147.79 156.88 43.2 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.122 1.369 . . . . 0.0 111.06 169.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 69.3 mt -133.49 146.38 32.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.766 1.626 . . . . 0.0 109.572 -174.375 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -142.11 161.78 37.15 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.98 1.712 . . . . 0.0 109.679 168.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 26.3 p -71.89 162.29 29.67 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.702 -1.249 . . . . 0.0 111.888 173.687 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -60.39 -33.41 72.44 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.161 -0.962 . . . . 0.0 111.953 169.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.91 -38.02 89.58 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.299 -0.875 . . . . 0.0 113.111 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -67.78 -39.67 84.07 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.09 -1.006 . . . . 0.0 112.144 172.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -62.23 -40.03 94.79 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.247 1.019 . . . . 0.0 112.288 174.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 12.5 t -64.72 -42.21 94.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 125.279 1.432 . . . . 0.0 112.028 169.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -62.12 -36.73 93.37 Favored Glycine 0 CA--C 1.537 1.432 0 O-C-N 121.008 -1.058 . . . . 0.0 112.504 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -67.07 -35.48 79.92 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.359 1.064 . . . . 0.0 113.197 169.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -56.84 -42.36 79.54 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.474 1.11 . . . . 0.0 112.132 172.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -75.21 -12.24 60.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.16 1.384 . . . . 0.0 114.337 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -136.59 30.51 2.87 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 126.008 1.723 . . . . 0.0 112.639 -171.741 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -173.32 -153.46 9.62 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 125.378 1.466 . . . . 0.0 112.623 -172.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -129.59 133.38 47.14 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.249 1.42 . . . . 0.0 111.375 177.229 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -153.88 6.09 0.32 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.64 1.176 . . . . 0.0 113.236 -170.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.6 m -58.99 -18.95 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -169.201 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -67.52 -15.81 63.86 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.126 1.37 . . . . 0.0 113.831 173.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 49.2 m -130.39 148.77 52.24 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.962 1.305 . . . . 0.0 112.677 -171.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 163.04 -176.59 39.27 Favored Glycine 0 CA--C 1.541 1.706 0 C-N-CA 125.097 1.332 . . . . 0.0 113.147 -178.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -52.6 154.83 11.25 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.205 3.27 . . . . 0.0 114.001 172.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 65.4 p -60.29 -19.36 54.66 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 177.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 21.4 m -65.89 -17.46 64.67 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.504 1.522 . . . . 0.0 114.628 174.634 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.21 0 CA-C-O 118.322 -1.265 . . . . 0.0 113.349 -179.543 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.616 0 C5'-C4'-O4' 113.208 2.863 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.219 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 48.9 m -140.73 -2.4 1.36 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.609 1.563 . . . . 0.0 114.327 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 67.8 m -138.14 170.8 15.4 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.809 1.244 . . . . 0.0 113.119 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 169.2 -22.86 0.1 OUTLIER Glycine 0 CA--C 1.538 1.483 0 N-CA-C 115.458 0.943 . . . . 0.0 115.458 177.881 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 60.1 p -71.88 -10.87 60.39 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 20.3 m -59.77 157.61 11.83 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.674 1.59 . . . . 0.0 113.75 178.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 77.54 -152.72 39.76 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 123.837 0.732 . . . . 0.0 113.55 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -155.83 172.99 33.88 Favored Glycine 0 CA--C 1.541 1.69 0 C-N-CA 124.932 1.254 . . . . 0.0 113.482 178.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -72.04 151.96 56.47 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.716 2.944 . . . . 0.0 113.431 -173.392 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -155.06 166.94 32.0 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.312 1.845 . . . . 0.0 110.44 173.242 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 91.0 mt -127.16 15.8 7.26 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.152 1.381 . . . . 0.0 114.32 -168.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -134.33 146.26 58.76 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.241 1.017 . . . . 0.0 112.859 -176.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.45 147.97 47.5 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.414 2.743 . . . . 0.0 111.654 173.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -140.41 31.34 1.91 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 125.608 1.563 . . . . 0.0 112.448 -170.783 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.65 112.49 11.47 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.226 1.41 . . . . 0.0 112.398 -174.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -156.13 -43.07 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.816 2.046 . . . . 0.0 109.729 170.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 -70.26 38.19 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.132 2.973 . . . . 0.0 112.941 168.396 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 46.3 t -128.07 126.11 65.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 125.005 1.322 . . . . 0.0 111.027 -168.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 83.8 mt -92.68 168.31 11.31 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.423 1.889 . . . . 0.0 111.723 174.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 41.2 t-80 -128.19 136.23 50.81 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.43 2.292 . . . . 0.0 106.928 166.478 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 10.7 t -132.77 136.02 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.602 1.161 . . . . 0.0 109.091 -171.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 16.5 m -124.82 135.51 53.0 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.109 1.364 . . . . 0.0 109.689 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -156.2 156.51 30.39 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 124.487 1.115 . . . . 0.0 112.671 -169.165 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.22 150.96 30.54 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.813 3.009 . . . . 0.0 112.644 168.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -56.18 -22.19 27.49 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -62.09 -27.66 69.07 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.456 1.503 . . . . 0.0 113.512 176.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -68.54 150.2 48.32 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.118 0.967 . . . . 0.0 112.968 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 36.0 mttm -135.08 174.29 10.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.366 1.866 . . . . 0.0 112.145 176.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.4 m -48.36 -36.35 14.35 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.026 1.73 . . . . 0.0 112.713 173.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.8 m -64.63 -45.33 87.27 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 175.603 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -63.49 -30.93 71.98 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.369 0.668 . . . . 0.0 111.416 175.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 73.6 mt -71.02 -46.62 61.82 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.821 0.849 . . . . 0.0 111.639 175.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -61.95 -31.11 71.42 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.639 -1.288 . . . . 0.0 113.422 171.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -72.65 -34.65 67.41 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.442 1.097 . . . . 0.0 113.26 172.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 65.2 tp -64.5 -30.61 71.64 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.469 1.108 . . . . 0.0 112.253 172.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -115.64 22.95 12.72 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.95 1.3 . . . . 0.0 113.938 -175.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 92.1 p -59.12 -21.61 59.57 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.309 1.043 . . . . 0.0 113.796 172.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -61.73 -19.2 62.16 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.505 1.522 . . . . 0.0 114.047 169.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -115.05 -39.39 3.66 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.389 1.475 . . . . 0.0 111.483 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 65.36 7.98 35.49 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 125.707 1.622 . . . . 0.0 117.06 169.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -143.06 17.61 1.93 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.194 1.398 . . . . 0.0 112.886 -170.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 19.5 pt -64.83 171.37 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 125.636 1.574 . . . . 0.0 113.577 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -134.55 144.05 47.75 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.301 1.441 . . . . 0.0 109.16 169.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 86.4 mt -121.63 133.97 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.154 0.982 . . . . 0.0 109.943 -169.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 71.2 m -134.82 97.03 3.66 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.138 1.775 . . . . 0.0 109.938 -176.771 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -57.86 158.32 6.61 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 8.9 mt -132.89 -42.93 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.974 1.309 . . . . 0.0 109.537 177.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -155.16 -179.03 7.68 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.461 1.504 . . . . 0.0 111.85 173.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -59.61 -16.16 23.81 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.805 1.642 . . . . 0.0 114.831 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 67.6 p -132.23 3.0 3.95 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.052 1.741 . . . . 0.0 114.577 -173.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 3.6 p -151.8 153.99 35.34 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 170.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -150.83 155.03 38.37 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.924 1.29 . . . . 0.0 112.353 -177.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -89.5 148.11 23.6 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.045 0.938 . . . . 0.0 109.517 167.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 56.4 t -138.61 111.24 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.956 0.902 . . . . 0.0 110.652 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 74.0 m -77.42 139.43 39.68 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.333 1.453 . . . . 0.0 111.44 174.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 52.1 mt -110.82 170.8 7.86 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.424 1.49 . . . . 0.0 111.625 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 61.9 m -77.97 -26.04 48.48 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -144.93 148.74 40.04 Favored Pre-proline 0 CA--C 1.544 0.734 0 C-N-CA 125.144 1.378 . . . . 0.0 111.207 178.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -55.1 -29.56 66.29 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.682 2.921 . . . . 0.0 114.551 171.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -59.89 -36.16 76.37 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.524 1.13 . . . . 0.0 113.1 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -67.28 -20.9 65.71 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.458 1.103 . . . . 0.0 113.252 -178.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 96.9 t -60.42 -44.43 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.241 1.016 . . . . 0.0 111.01 176.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -68.03 -35.42 78.24 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.721 0.808 . . . . 0.0 111.497 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 68.2 mt -61.79 -48.29 89.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.813 0.845 . . . . 0.0 110.453 176.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.8 82.31 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 72.0 t -65.9 -41.43 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 O-C-N 121.134 -0.979 . . . . 0.0 111.209 171.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -62.43 -32.31 73.14 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.148 0.979 . . . . 0.0 113.271 176.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 39.4 p -86.24 -27.52 24.4 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.019 0.928 . . . . 0.0 113.086 178.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 11.2 t -69.58 -24.05 63.63 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -60.67 -19.31 58.11 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -90.16 -10.34 44.89 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.305 1.442 . . . . 0.0 114.066 176.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -68.92 152.53 45.16 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.204 1.002 . . . . 0.0 113.535 -173.508 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -140.61 2.93 1.85 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.222 1.409 . . . . 0.0 113.864 175.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 77.4 p -135.84 1.07 2.74 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.271 1.828 . . . . 0.0 113.742 -177.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -156.34 175.04 14.53 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.425 2.29 . . . . 0.0 109.591 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 46.3 ttm180 -147.04 146.84 30.15 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.031 1.332 . . . . 0.0 110.984 175.444 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 48.3 mt -129.27 139.48 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.972 1.709 . . . . 0.0 109.055 175.347 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -147.57 171.27 15.84 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.449 1.9 . . . . 0.0 109.829 173.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 19.0 p -72.86 164.01 27.26 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 120.334 -1.479 . . . . 0.0 112.319 172.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -52.85 -44.6 66.88 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.523 0.729 . . . . 0.0 111.518 168.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -69.14 -35.25 76.17 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -63.58 -43.72 96.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.168 0.895 . . . . 0.0 111.965 173.471 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -58.92 -50.82 72.61 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.005 0.522 . . . . 0.0 111.773 174.208 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 45.8 t -57.61 -50.69 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.111 0.965 . . . . 0.0 111.692 176.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -61.92 -38.61 96.3 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 123.482 0.563 . . . . 0.0 113.457 -175.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -66.97 -51.36 56.14 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.079 0.952 . . . . 0.0 111.745 171.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -58.27 -39.35 78.99 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.844 1.658 . . . . 0.0 113.547 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -75.56 -6.76 51.91 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -123.9 -9.93 7.74 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.646 1.721 . . . . 0.0 115.646 -173.271 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 167.45 176.88 38.58 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 120.01 1.277 . . . . 0.0 116.107 169.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.2 161.51 6.96 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.927 1.291 . . . . 0.0 112.742 170.845 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -114.65 7.96 16.13 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.653 1.181 . . . . 0.0 113.116 -173.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 53.0 t -62.75 143.35 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.538 1.535 . . . . 0.0 110.775 172.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -146.46 -45.77 0.19 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.639 1.176 . . . . 0.0 112.82 176.425 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 30.9 m -67.99 167.05 14.58 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.963 1.305 . . . . 0.0 112.959 172.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -163.82 -178.34 37.34 Favored Glycine 0 CA--C 1.539 1.558 0 C-N-CA 124.466 1.031 . . . . 0.0 113.366 175.432 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -52.4 -29.29 38.67 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 124.248 3.299 . . . . 0.0 115.467 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 19.3 m -75.42 -15.19 60.47 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 65.3 m -66.35 152.66 44.55 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.043 0.937 . . . . 0.0 112.948 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.261 0 C-N-CA 125.198 1.38 . . . . 0.0 112.764 178.674 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.725 0 C5'-C4'-O4' 113.697 3.212 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.571 0 N-CA-C 111.439 -0.664 . . . . 0.0 111.439 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 62.9 p -153.5 165.21 36.58 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.223 1.409 . . . . 0.0 112.566 -178.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 48.9 p -66.87 162.79 20.92 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.073 1.349 . . . . 0.0 113.137 173.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 166.6 -27.79 0.17 Allowed Glycine 0 CA--C 1.534 1.248 0 N-CA-C 115.346 0.898 . . . . 0.0 115.346 175.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 9.7 t -149.03 151.25 34.18 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.127 1.371 . . . . 0.0 111.149 176.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 45.9 p -71.2 157.16 38.62 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.337 1.055 . . . . 0.0 113.277 178.084 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -178.6 -23.45 0.03 OUTLIER Glycine 0 CA--C 1.537 1.414 0 N-CA-C 116.069 1.188 . . . . 0.0 116.069 174.145 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 147.02 -61.69 0.46 Allowed Glycine 0 CA--C 1.537 1.449 0 CA-C-N 118.59 1.195 . . . . 0.0 112.578 177.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.45 -27.77 70.02 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 124.046 3.164 . . . . 0.0 113.188 169.081 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -142.73 156.28 44.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.764 2.026 . . . . 0.0 109.847 169.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 95.9 mt -141.8 26.5 1.89 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.703 2.001 . . . . 0.0 111.436 -173.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -125.43 74.01 68.33 Favored Pre-proline 0 CA--C 1.548 0.878 0 C-N-CA 125.671 1.589 . . . . 0.0 111.379 -168.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -69.62 161.19 46.89 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.113 2.542 . . . . 0.0 112.928 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -63.89 11.31 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 126.295 1.838 . . . . 0.0 115.371 172.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -125.09 6.86 7.9 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 127.655 2.382 . . . . 0.0 112.875 176.391 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -60.37 -25.96 66.27 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 120.801 -1.187 . . . . 0.0 113.791 178.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -92.82 18.94 8.17 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.484 1.914 . . . . 0.0 113.737 176.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 24.6 t -125.85 147.44 30.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.773 1.229 . . . . 0.0 111.98 -169.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 74.3 mt -118.45 164.08 15.79 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.568 2.347 . . . . 0.0 110.849 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -122.87 139.2 54.28 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 126.783 2.033 . . . . 0.0 107.772 168.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.0 t -131.34 142.11 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.855 1.262 . . . . 0.0 109.345 -169.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.54 136.16 50.38 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.458 1.503 . . . . 0.0 109.581 -178.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -160.08 157.88 25.69 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 123.598 0.759 . . . . 0.0 112.963 -170.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.65 145.75 68.86 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.757 2.971 . . . . 0.0 112.499 168.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -55.69 -24.59 35.27 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 -176.329 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -67.1 -17.63 64.96 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.985 1.314 . . . . 0.0 114.162 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -62.63 155.08 27.16 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.094 0.958 . . . . 0.0 112.979 173.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -139.53 165.79 26.29 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.528 1.931 . . . . 0.0 110.674 -173.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.7 m -57.03 -32.48 66.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.115 0.966 . . . . 0.0 111.763 176.046 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 43.6 m -66.58 -42.03 87.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 173.331 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -65.79 -31.71 72.83 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.438 -0.789 . . . . 0.0 111.248 174.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.4 mt -70.68 -44.92 66.0 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.861 0.864 . . . . 0.0 111.501 174.262 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -57.51 -38.2 74.26 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.091 -1.006 . . . . 0.0 112.407 169.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -68.29 -40.36 81.8 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.98 0.809 . . . . 0.0 112.999 175.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.0 tp -64.32 -36.02 82.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.842 1.257 . . . . 0.0 112.273 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -106.84 10.42 30.68 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.569 1.148 . . . . 0.0 113.419 -176.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 22.2 t -55.81 -31.74 62.93 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.664 1.586 . . . . 0.0 113.791 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.84 -15.23 11.5 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.443 1.497 . . . . 0.0 115.021 178.068 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -101.63 -0.52 34.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.888 1.275 . . . . 0.0 114.11 -176.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 77.31 -41.73 1.85 Allowed Glycine 0 CA--C 1.536 1.399 0 C-N-CA 126.086 1.803 . . . . 0.0 116.101 169.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -148.59 130.81 15.5 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.282 1.433 . . . . 0.0 110.673 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 18.7 pt -145.92 174.73 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.435 1.494 . . . . 0.0 111.478 -172.351 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.88 146.82 41.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.813 1.245 . . . . 0.0 109.001 168.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 67.9 mt -127.78 130.07 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.032 1.333 . . . . 0.0 109.222 -174.019 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 51.8 m -136.85 94.74 3.01 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.195 1.398 . . . . 0.0 111.022 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -55.83 154.33 7.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.701 1.2 . . . . 0.0 113.633 176.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 17.7 pt -132.27 -28.97 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.474 1.109 . . . . 0.0 113.617 170.61 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -160.15 -175.16 4.91 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.917 1.287 . . . . 0.0 112.44 172.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -57.89 -22.0 46.17 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 -177.197 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.6 p -134.2 5.33 3.53 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.938 1.295 . . . . 0.0 113.979 -171.123 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 60.9 m -143.56 147.92 35.16 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.705 1.202 . . . . 0.0 113.295 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.26 156.23 39.29 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.299 1.44 . . . . 0.0 111.753 175.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -89.9 151.57 21.67 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.557 0.743 . . . . 0.0 110.18 168.115 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.5 t -137.98 115.9 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.496 1.118 . . . . 0.0 110.325 176.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 16.3 m -83.62 140.64 32.08 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.074 1.35 . . . . 0.0 110.673 172.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 80.4 mt -123.18 147.04 47.28 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.769 1.227 . . . . 0.0 110.2 176.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 5.2 m -65.8 -16.01 63.41 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 115.767 1.766 . . . . 0.0 115.767 -172.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -140.25 148.09 52.75 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 124.562 1.145 . . . . 0.0 111.429 175.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -70.0 -20.75 33.29 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.105 2.537 . . . . 0.0 113.579 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -66.59 -32.61 74.06 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.825 -1.172 . . . . 0.0 112.346 172.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -67.29 -31.2 71.35 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.163 0.985 . . . . 0.0 112.189 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.2 t -58.64 -46.42 90.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.242 1.417 . . . . 0.0 110.741 173.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -63.86 -41.92 97.66 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.501 0.72 . . . . 0.0 112.031 176.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 94.6 mt -63.1 -42.55 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.579 0.752 . . . . 0.0 111.292 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.41 -39.72 95.26 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.114 -0.991 . . . . 0.0 113.094 176.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 69.2 t -66.16 -42.02 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 O-C-N 121.218 -0.926 . . . . 0.0 111.347 172.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -61.22 -37.66 83.84 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.121 0.968 . . . . 0.0 113.116 176.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 22.0 p -83.32 -28.87 28.74 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.556 1.142 . . . . 0.0 113.237 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 8.7 t -60.78 -19.38 59.23 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 171.235 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -51.77 -26.54 9.84 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.703 1.601 . . . . 0.0 113.661 169.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -114.9 10.15 16.31 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.606 1.562 . . . . 0.0 113.093 -174.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -64.71 156.56 29.97 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.931 1.293 . . . . 0.0 113.095 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.55 -5.46 1.21 Allowed 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 176.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 51.0 m -137.31 5.08 2.71 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.392 1.477 . . . . 0.0 113.629 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 49.5 p90 -157.92 176.07 13.02 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.241 1.816 . . . . 0.0 111.208 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 69.5 ttt-85 -147.34 145.21 29.24 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.003 2.121 . . . . 0.0 109.997 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 79.2 mt -132.5 141.61 44.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.434 1.494 . . . . 0.0 109.841 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -143.12 163.82 31.81 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.109 1.764 . . . . 0.0 110.509 169.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 65.1 p -73.02 161.51 30.59 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.753 -1.217 . . . . 0.0 112.347 174.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -60.42 -34.15 73.54 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.206 -0.934 . . . . 0.0 111.591 168.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -63.88 -37.82 88.81 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.447 -0.783 . . . . 0.0 113.09 174.308 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -66.52 -42.36 87.41 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.13 -0.982 . . . . 0.0 112.168 170.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -56.74 -47.99 78.8 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 118.777 0.717 . . . . 0.0 111.422 173.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 22.7 t -58.91 -44.18 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.038 1.335 . . . . 0.0 112.288 173.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -62.8 -37.57 95.08 Favored Glycine 0 CA--C 1.536 1.385 0 O-C-N 121.604 -0.685 . . . . 0.0 113.09 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -71.33 -32.0 68.05 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.638 1.175 . . . . 0.0 113.019 169.443 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 18.6 tptp -65.44 -40.22 93.03 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.373 1.469 . . . . 0.0 112.976 176.602 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 56.4 mm-40 -62.45 110.7 1.75 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.262 1.425 . . . . 0.0 111.931 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -148.08 19.15 1.11 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.899 1.28 . . . . 0.0 113.676 -175.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -166.56 36.69 0.24 Allowed Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.13 0.872 . . . . 0.0 114.854 -173.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -62.23 -21.74 65.4 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.893 1.677 . . . . 0.0 114.994 -173.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -73.58 25.48 0.07 Allowed 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 126.662 1.985 . . . . 0.0 115.659 -171.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.4 m -63.54 -14.32 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -75.88 46.87 0.4 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 127.013 2.125 . . . . 0.0 113.589 -175.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 97.4 p -143.35 172.78 12.3 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.775 1.63 . . . . 0.0 112.882 -173.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 60.54 -148.48 44.5 Favored Glycine 0 CA--C 1.543 1.817 0 C-N-CA 123.877 0.751 . . . . 0.0 113.335 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.32 3.12 3.76 Favored 'Trans proline' 0 CA--C 1.548 1.214 0 C-N-CA 123.718 2.945 . . . . 0.0 114.193 177.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 40.9 m -120.25 12.55 11.8 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.071 1.749 . . . . 0.0 113.25 -174.114 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 83.9 p -65.82 -19.36 65.85 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.205 0 C-N-CA 125.53 1.538 . . . . 0.0 112.649 178.713 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.71 0 O5'-C5'-C4' 114.033 2.738 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.54 0 N-CA-C 112.054 -0.419 . . . . 0.0 112.054 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 23.1 m -137.13 9.71 3.0 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.932 1.293 . . . . 0.0 113.888 -172.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 60.2 p -71.9 -12.62 61.35 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -178.52 -172.85 43.33 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.86 1.219 . . . . 0.0 113.62 -178.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 78.8 p -134.86 11.94 3.65 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.648 1.579 . . . . 0.0 113.936 -174.391 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 89.8 p -145.76 170.44 16.52 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.107 1.763 . . . . 0.0 112.264 -178.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -161.18 36.64 0.41 Allowed Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.069 0.842 . . . . 0.0 114.484 -173.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -153.77 58.56 0.4 Allowed Glycine 0 CA--C 1.539 1.582 0 C-N-CA 124.772 1.177 . . . . 0.0 114.083 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -75.86 -2.5 12.68 Favored 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 124.129 3.219 . . . . 0.0 114.794 -175.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -139.98 150.67 44.75 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.184 1.394 . . . . 0.0 112.411 -173.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 84.6 mt -78.84 58.67 2.4 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.632 1.973 . . . . 0.0 112.59 -176.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 42.3 tt0 -52.52 130.99 45.02 Favored Pre-proline 0 CA--C 1.554 1.101 0 C-N-CA 125.302 1.441 . . . . 0.0 112.091 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -74.12 164.86 33.34 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.282 2.655 . . . . 0.0 113.661 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -146.91 165.13 30.7 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.772 2.429 . . . . 0.0 109.65 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -129.0 23.62 5.67 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 125.489 1.515 . . . . 0.0 113.917 -175.072 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -63.35 -22.8 67.1 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 121.087 -1.008 . . . . 0.0 113.543 176.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -90.32 15.36 10.66 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.757 2.023 . . . . 0.0 113.93 175.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 42.5 t -117.59 141.78 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.929 1.292 . . . . 0.0 111.182 -173.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 93.7 mt -108.16 163.58 13.05 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 126.819 2.048 . . . . 0.0 111.489 176.234 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -122.53 136.19 54.83 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.699 2.0 . . . . 0.0 107.026 166.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 4.8 t -132.27 138.59 52.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 124.893 1.277 . . . . 0.0 109.088 -169.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.2 m -129.55 136.17 49.49 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.924 1.29 . . . . 0.0 109.529 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -158.85 155.96 25.8 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.404 1.082 . . . . 0.0 112.538 -169.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.13 144.85 78.86 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.5 2.8 . . . . 0.0 111.418 167.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 7.2 ptpt -59.59 -19.14 46.72 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -176.774 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.43 -21.77 66.49 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.696 1.598 . . . . 0.0 114.016 172.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -63.36 150.94 42.21 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.002 0.819 . . . . 0.0 112.276 172.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -130.73 169.1 16.14 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.329 1.852 . . . . 0.0 111.634 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.5 m -50.92 -34.46 28.63 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.652 1.181 . . . . 0.0 112.513 171.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 43.2 m -66.19 -40.18 90.24 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -66.82 -31.97 72.93 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.608 -0.683 . . . . 0.0 111.168 173.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 90.8 mt -70.56 -41.38 72.52 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.615 0.766 . . . . 0.0 111.485 174.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -60.55 -42.22 96.12 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.959 -1.088 . . . . 0.0 111.634 169.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.3 tt0 -60.78 -33.91 73.68 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.122 -0.986 . . . . 0.0 112.681 175.114 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 44.9 tp -79.49 -27.23 41.48 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.849 1.26 . . . . 0.0 114.105 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -128.76 -17.5 4.02 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 116.888 2.181 . . . . 0.0 116.888 -168.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 14.8 t -60.87 -21.8 63.63 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.63 1.559 . . . . 0.0 113.43 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -54.36 -24.32 19.01 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.413 1.485 . . . . 0.0 114.521 171.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -80.46 -1.23 40.75 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 99.77 -44.67 1.61 Allowed Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.705 1.622 . . . . 0.0 114.541 168.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -152.69 136.91 16.54 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.12 1.368 . . . . 0.0 110.391 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 29.1 pt -144.42 171.79 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.679 1.191 . . . . 0.0 112.298 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -143.89 145.82 32.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.133 1.373 . . . . 0.0 109.146 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 77.0 mt -127.15 128.71 70.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.752 1.221 . . . . 0.0 109.158 -172.462 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 46.3 m -136.18 99.38 4.11 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.455 1.502 . . . . 0.0 111.071 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -58.42 151.1 20.74 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.196 0.998 . . . . 0.0 113.63 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 38.2 pt -133.59 -19.84 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.778 1.231 . . . . 0.0 113.278 169.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -152.0 178.19 9.69 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.743 1.217 . . . . 0.0 111.713 172.826 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -66.17 -14.66 62.21 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.158 1.783 . . . . 0.0 112.926 174.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.0 p -134.64 5.03 3.39 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.598 1.959 . . . . 0.0 113.718 -172.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 88.0 p -155.05 154.9 33.16 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.39 161.5 42.25 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.663 1.585 . . . . 0.0 112.088 -177.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -93.48 149.66 21.06 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.982 0.913 . . . . 0.0 110.054 167.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.2 t -138.3 114.91 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.174 0.99 . . . . 0.0 110.746 177.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 19.3 m -77.61 141.21 39.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.835 1.254 . . . . 0.0 111.066 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 70.7 mt -121.08 165.62 15.07 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.42 1.488 . . . . 0.0 110.621 171.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 55.0 m -63.67 -29.66 70.86 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -146.47 152.4 45.71 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.628 1.171 . . . . 0.0 112.385 -176.703 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.37 -17.23 39.45 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.329 2.686 . . . . 0.0 113.497 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -63.23 -35.61 80.9 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.616 -1.303 . . . . 0.0 111.539 169.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -74.96 -30.57 61.25 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.125 0.97 . . . . 0.0 112.356 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 13.5 t -57.02 -44.96 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.008 0.923 . . . . 0.0 111.173 171.014 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -60.81 -41.27 95.34 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.107 0.563 . . . . 0.0 112.272 176.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 98.8 mt -61.43 -50.64 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.806 0.842 . . . . 0.0 110.668 176.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.87 -36.54 83.64 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 78.3 t -65.75 -41.16 89.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 121.117 -0.989 . . . . 0.0 111.242 171.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -63.2 -43.84 97.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.795 0.725 . . . . 0.0 112.832 176.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 35.3 p -68.86 -27.82 66.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.708 0.803 . . . . 0.0 113.068 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.3 t -65.53 -18.24 65.18 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 174.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -60.29 -14.32 17.52 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.702 1.201 . . . . 0.0 114.043 176.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -128.95 13.29 6.27 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.076 1.75 . . . . 0.0 112.609 -176.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.05 159.21 23.69 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.997 1.319 . . . . 0.0 113.044 175.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -138.06 -0.99 2.01 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -178.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 8.7 t -145.03 4.74 1.1 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.218 1.407 . . . . 0.0 113.006 -178.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -159.27 174.85 14.16 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.378 1.471 . . . . 0.0 111.637 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 79.2 ttt-85 -145.01 147.82 33.05 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.386 1.874 . . . . 0.0 110.313 169.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 68.4 mt -129.1 141.45 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.336 1.855 . . . . 0.0 109.611 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -144.52 166.07 26.2 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.932 1.693 . . . . 0.0 109.728 169.031 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 25.7 p -71.79 162.28 29.68 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.696 -1.252 . . . . 0.0 111.677 175.15 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -57.09 -39.19 74.52 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.278 -0.889 . . . . 0.0 111.829 168.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.76 -36.97 86.02 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -67.33 -40.96 85.95 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.171 -0.956 . . . . 0.0 112.145 173.368 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -59.55 -49.11 79.03 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.42 0.555 . . . . 0.0 111.476 172.605 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 21.0 t -56.72 -45.23 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.647 1.179 . . . . 0.0 111.924 174.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -63.3 -40.56 99.12 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 123.714 0.673 . . . . 0.0 113.287 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -68.76 -28.09 66.48 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 118.169 0.985 . . . . 0.0 113.546 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -74.69 -17.19 60.71 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.724 1.61 . . . . 0.0 114.143 179.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -59.71 151.77 24.3 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.288 1.035 . . . . 0.0 112.869 175.365 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -145.53 20.55 1.51 Allowed 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -173.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -88.01 152.22 23.58 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 124.044 0.83 . . . . 0.0 113.688 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -158.62 150.81 21.53 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.271 1.828 . . . . 0.0 110.258 178.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -56.31 -36.67 68.96 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -176.181 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.96 -20.68 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 125.558 1.543 . . . . 0.0 113.707 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -89.77 -0.45 57.56 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.816 1.647 . . . . 0.0 112.93 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 22.5 m 65.39 -31.76 0.14 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 129.3 3.04 . . . . 0.0 117.588 174.366 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 169.16 52.98 0.03 OUTLIER Glycine 0 CA--C 1.537 1.444 0 CA-C-N 119.747 1.158 . . . . 0.0 115.246 178.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -67.73 -28.98 36.45 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 122.802 2.335 . . . . 0.0 113.065 -177.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 18.2 m -72.52 -13.41 61.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.214 1.405 . . . . 0.0 114.243 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 44.5 m -72.03 -11.17 60.64 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -175.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.199 0 C-N-CA 124.969 1.271 . . . . 0.0 113.044 178.93 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.927 0 C5'-C4'-O4' 113.169 2.835 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 N-CA-C 112.249 -0.341 . . . . 0.0 112.249 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 50.5 m -135.67 6.34 3.2 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.081 1.352 . . . . 0.0 113.817 -171.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 15.0 m -78.46 35.42 0.23 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 127.071 2.148 . . . . 0.0 114.791 -169.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -169.09 -149.06 6.04 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 125.348 1.451 . . . . 0.0 112.01 -175.237 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 31.8 p -59.83 -15.13 18.55 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 169.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 19.3 p -69.23 -11.77 61.09 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.399 2.279 . . . . 0.0 115.941 178.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -170.47 -179.45 41.89 Favored Glycine 0 CA--C 1.534 1.258 0 CA-C-N 119.882 1.219 . . . . 0.0 114.977 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 167.21 -158.19 31.0 Favored Glycine 0 CA--C 1.539 1.545 0 C-N-CA 124.186 0.898 . . . . 0.0 113.011 -174.363 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.73 -19.55 10.92 Favored 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 124.717 3.611 . . . . 0.0 115.551 170.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -135.02 155.74 50.25 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.407 1.883 . . . . 0.0 110.524 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.2 pp -69.22 -5.98 26.13 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 -173.699 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -146.99 81.0 9.21 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 126.771 2.028 . . . . 0.0 109.244 178.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -57.34 152.39 46.69 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.418 2.745 . . . . 0.0 113.795 177.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.27 -14.91 2.93 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 173.786 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 73.4 mtt180 28.95 52.04 0.07 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 129.798 3.239 . . . . 0.0 116.077 170.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.29 -15.57 57.64 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 -96.27 13.79 26.36 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.909 2.084 . . . . 0.0 113.695 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 55.4 t -128.0 143.5 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.915 1.286 . . . . 0.0 111.777 -171.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 72.1 mt -107.16 166.3 10.73 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 127.342 2.257 . . . . 0.0 111.496 175.697 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 22.8 t-80 -121.53 137.55 54.68 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.974 2.11 . . . . 0.0 107.103 166.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 13.4 t -133.81 139.72 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.877 1.271 . . . . 0.0 108.958 -169.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.0 m -128.72 132.52 47.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.193 1.397 . . . . 0.0 109.252 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -151.49 159.71 32.93 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.444 1.098 . . . . 0.0 112.895 -168.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -52.15 150.15 19.96 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.19 3.26 . . . . 0.0 114.058 170.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.0 pttm -53.67 -28.05 31.1 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.456 1.503 . . . . 0.0 115.048 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -81.55 -12.91 58.63 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.406 1.483 . . . . 0.0 114.212 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 7.6 m0 -65.63 152.8 43.31 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.305 0.957 . . . . 0.0 112.982 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -129.72 168.93 15.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.403 1.881 . . . . 0.0 111.832 -178.861 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.2 m -48.53 -35.45 13.29 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.444 1.498 . . . . 0.0 112.213 169.35 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 70.8 m -64.41 -43.72 93.5 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -64.54 -33.18 75.32 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.751 -0.593 . . . . 0.0 111.147 174.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.92 -44.57 65.91 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.87 0.868 . . . . 0.0 111.792 176.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.38 -43.42 92.91 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.166 -0.959 . . . . 0.0 112.018 169.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -61.43 -32.21 72.17 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.923 0.783 . . . . 0.0 112.977 175.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 52.7 tp -74.83 -34.3 62.31 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.499 1.12 . . . . 0.0 113.254 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -116.53 -5.88 11.69 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -169.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 87.1 p -57.62 -22.88 48.0 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 114.549 1.315 . . . . 0.0 114.549 175.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.4 -21.62 51.21 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.063 1.345 . . . . 0.0 114.17 173.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -94.24 -5.89 45.86 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.157 1.383 . . . . 0.0 113.779 177.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 109.69 -154.07 16.68 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 125.071 1.319 . . . . 0.0 112.213 -173.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -61.37 153.61 26.34 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.652 0.781 . . . . 0.0 112.13 169.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 33.0 pt -142.54 176.92 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 125.389 1.476 . . . . 0.0 111.795 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -143.82 146.16 32.87 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.2 1.4 . . . . 0.0 108.926 169.03 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 77.8 mt -129.48 133.28 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.679 1.192 . . . . 0.0 109.289 -172.402 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 39.5 m -134.78 97.38 3.76 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.742 1.617 . . . . 0.0 110.497 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -60.01 153.29 21.79 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.731 1.212 . . . . 0.0 113.955 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 28.9 pt -133.44 -24.47 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.817 1.247 . . . . 0.0 112.9 169.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -149.75 173.18 14.0 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.748 1.619 . . . . 0.0 112.064 173.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.81 -20.48 50.6 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.557 1.543 . . . . 0.0 113.66 169.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.4 p -126.58 0.93 6.86 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.046 1.738 . . . . 0.0 114.197 -172.09 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 36.3 p -154.4 151.26 28.8 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 174.28 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.87 160.58 43.08 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.617 1.567 . . . . 0.0 111.96 -176.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -89.13 149.76 23.02 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.448 0.699 . . . . 0.0 110.341 167.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 48.5 t -138.53 119.15 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 124.564 1.146 . . . . 0.0 110.773 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 14.1 t -80.99 144.52 31.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.191 1.396 . . . . 0.0 111.881 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 86.0 mt -129.66 155.6 45.61 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.737 1.615 . . . . 0.0 110.871 174.364 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 48.9 m -68.85 -24.17 64.33 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -169.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -137.99 151.45 70.12 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.75 1.22 . . . . 0.0 111.527 172.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -67.97 -18.63 46.42 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.262 2.641 . . . . 0.0 113.744 174.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.17 -37.93 89.24 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.662 -1.274 . . . . 0.0 111.98 170.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.3 -32.94 74.26 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.405 -0.81 . . . . 0.0 112.092 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.8 t -58.93 -47.28 90.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.79 1.236 . . . . 0.0 110.506 172.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -62.48 -42.87 99.79 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.571 -0.706 . . . . 0.0 112.211 176.252 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 87.4 mt -62.76 -43.81 99.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 123.76 0.824 . . . . 0.0 111.368 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.1 -38.56 91.68 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.324 -0.86 . . . . 0.0 113.069 177.157 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 71.1 t -66.76 -42.47 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 121.283 -0.886 . . . . 0.0 111.364 173.002 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -60.79 -44.44 96.8 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.032 0.833 . . . . 0.0 112.661 176.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 26.1 p -74.69 -21.74 59.23 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.224 1.009 . . . . 0.0 113.649 -178.008 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 21.2 p -65.2 -15.17 62.17 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 175.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -56.41 -15.14 3.64 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.671 1.588 . . . . 0.0 114.122 172.285 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -126.93 16.04 7.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.286 1.834 . . . . 0.0 112.333 -174.528 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.51 -36.75 84.77 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -174.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 52.68 -18.65 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 129.751 3.22 . . . . 0.0 118.906 -175.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 50.2 m -135.48 1.36 2.86 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.226 1.411 . . . . 0.0 114.371 -173.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -155.58 176.14 12.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.183 2.193 . . . . 0.0 109.56 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -144.6 150.26 37.15 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.289 1.036 . . . . 0.0 111.767 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 78.2 mt -135.66 144.11 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 126.083 1.753 . . . . 0.0 109.5 -177.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -147.54 168.63 21.47 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.148 1.779 . . . . 0.0 110.376 169.535 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 18.6 p -71.65 163.59 27.48 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 120.659 -1.276 . . . . 0.0 111.702 172.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -55.35 -42.06 73.35 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.272 -0.892 . . . . 0.0 112.308 169.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.25 92.94 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.653 0.781 . . . . 0.0 112.868 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.45 -31.9 72.4 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.442 -0.786 . . . . 0.0 112.66 175.359 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -67.24 -49.98 62.4 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.063 0.847 . . . . 0.0 111.415 169.016 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 8.6 t -53.64 -42.03 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.502 1.121 . . . . 0.0 111.795 178.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -68.71 -9.97 60.01 Favored Glycine 0 CA--C 1.54 1.634 0 N-CA-C 115.468 0.947 . . . . 0.0 115.468 178.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -114.02 -15.77 12.25 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.805 1.642 . . . . 0.0 113.971 176.129 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 40.7 tttp -46.37 -36.54 6.51 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 126.62 1.968 . . . . 0.0 115.063 -170.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -66.75 -20.79 66.03 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -177.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -147.62 -18.76 0.37 Allowed 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 -172.585 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -57.67 -23.94 51.52 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 126.136 1.826 . . . . 0.0 116.902 -169.835 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -141.27 156.62 45.85 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.134 1.373 . . . . 0.0 111.234 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -132.61 21.22 4.27 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.099 1.36 . . . . 0.0 113.054 -168.475 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 13.7 p -143.44 147.26 20.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 125.207 1.403 . . . . 0.0 111.309 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -140.94 -21.09 0.79 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 125.574 1.55 . . . . 0.0 114.152 -174.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 45.9 m -145.81 166.43 25.96 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.66 1.584 . . . . 0.0 111.848 -175.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -170.1 176.67 43.75 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.668 1.128 . . . . 0.0 113.494 178.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -72.29 -10.86 26.24 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.118 3.212 . . . . 0.0 114.539 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 57.4 p -60.61 -15.85 32.39 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.489 1.516 . . . . 0.0 114.962 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 83.3 p -69.09 -17.01 63.81 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 173.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.266 0 CA-C-O 118.308 -1.273 . . . . 0.0 113.423 179.669 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.03 0 C5'-C4'-O4' 112.891 2.637 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.559 0 N-CA-C 111.883 -0.487 . . . . 0.0 111.883 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 82.5 p -140.41 10.57 2.3 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -174.107 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 17.4 m 57.37 23.47 8.99 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.991 1.717 . . . . 0.0 115.038 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -164.22 172.25 39.98 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 124.998 1.285 . . . . 0.0 113.222 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 20.4 m -57.79 -19.36 27.76 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.434 1.642 . . . . 0.0 115.434 -170.303 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 19.7 m -65.77 -19.41 65.88 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.182 1.393 . . . . 0.0 114.488 175.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -179.95 5.95 0.02 OUTLIER Glycine 0 CA--C 1.538 1.52 0 N-CA-C 118.263 2.065 . . . . 0.0 118.263 -177.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 177.26 61.38 0.06 OUTLIER Glycine 0 CA--C 1.537 1.408 0 CA-C-N 120.175 1.987 . . . . 0.0 114.748 176.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -70.52 168.11 23.49 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.474 2.783 . . . . 0.0 113.163 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -144.23 138.65 28.17 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.145 1.378 . . . . 0.0 110.337 169.255 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.88 17.11 0.98 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.114 1.766 . . . . 0.0 113.278 -173.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -53.82 147.2 24.19 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 124.873 1.269 . . . . 0.0 113.614 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.37 164.17 36.62 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.233 2.622 . . . . 0.0 112.612 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -127.31 16.4 7.15 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.743 1.617 . . . . 0.0 112.864 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 51.38 21.17 1.12 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 128.291 2.636 . . . . 0.0 115.696 -175.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -66.91 -17.01 64.7 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.246 1.419 . . . . 0.0 113.234 169.563 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -95.2 14.67 21.42 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.899 2.08 . . . . 0.0 113.386 175.52 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 39.8 t -122.19 142.9 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 124.856 1.263 . . . . 0.0 111.583 -170.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 76.5 mt -114.12 164.35 13.97 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 127.328 2.251 . . . . 0.0 110.868 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -120.95 140.24 52.14 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.875 2.07 . . . . 0.0 107.772 168.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.5 t -133.62 142.79 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 C-N-CA 124.776 1.23 . . . . 0.0 109.15 -169.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 12.2 m -132.27 134.05 44.82 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.215 1.406 . . . . 0.0 109.581 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -158.55 157.32 28.6 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.293 1.037 . . . . 0.0 112.561 -169.495 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.83 144.17 78.24 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 123.53 2.82 . . . . 0.0 112.179 168.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -55.2 -24.27 26.3 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.44 -13.96 54.32 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.247 1.419 . . . . 0.0 114.554 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -68.99 156.0 39.37 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.5 1.12 . . . . 0.0 112.877 172.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -129.16 170.11 13.95 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.381 1.872 . . . . 0.0 111.058 174.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.1 m -51.81 -33.53 36.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.788 1.235 . . . . 0.0 111.943 169.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.3 m -64.83 -42.3 95.07 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 175.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -66.31 -31.8 72.81 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.626 -0.671 . . . . 0.0 111.094 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.2 mt -70.98 -43.02 68.92 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.78 0.832 . . . . 0.0 111.395 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -57.47 -44.1 84.6 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.926 -1.109 . . . . 0.0 111.511 169.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -62.45 -33.51 74.96 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 50.7 tp -73.93 -29.72 62.18 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.444 1.098 . . . . 0.0 113.412 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -120.38 -4.39 9.9 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.947 1.832 . . . . 0.0 115.947 -169.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 86.5 p -59.42 -20.24 53.46 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 173.405 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -60.77 -9.19 3.68 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.923 1.689 . . . . 0.0 114.87 172.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -119.28 14.97 13.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.745 1.618 . . . . 0.0 113.398 -172.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 89.31 -149.41 20.67 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.484 1.04 . . . . 0.0 112.704 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -62.58 142.55 57.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.482 0.713 . . . . 0.0 111.281 170.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 38.5 pt -142.57 174.16 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.489 1.515 . . . . 0.0 111.698 -176.755 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -138.79 142.37 38.74 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.897 1.279 . . . . 0.0 109.044 168.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 69.8 mt -122.33 124.89 71.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 125.067 1.347 . . . . 0.0 108.471 -176.633 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 75.7 m -135.25 94.83 3.18 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.416 1.486 . . . . 0.0 110.904 -169.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 86.7 m95 -56.27 152.72 10.6 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.325 1.05 . . . . 0.0 113.648 178.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 27.4 pt -129.88 -22.59 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 124.707 1.203 . . . . 0.0 113.206 170.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.43 -174.12 3.88 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.713 2.005 . . . . 0.0 110.233 169.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -74.08 -5.32 40.91 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -176.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 69.5 p -135.44 2.15 2.95 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 119.757 1.162 . . . . 0.0 114.064 -177.246 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 45.5 m -144.51 150.57 37.79 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.411 1.485 . . . . 0.0 113.295 173.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.6 156.89 41.37 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.195 1.398 . . . . 0.0 111.588 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -89.87 151.1 21.92 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.492 0.717 . . . . 0.0 109.874 167.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 63.1 t -138.34 114.53 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 124.137 0.975 . . . . 0.0 110.536 176.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 32.5 m -79.32 138.93 37.9 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.687 1.195 . . . . 0.0 110.533 171.195 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 56.1 mt -113.81 164.49 13.67 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.526 1.13 . . . . 0.0 111.703 175.752 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 22.7 t -55.49 -40.96 72.37 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.478 1.111 . . . . 0.0 113.452 -175.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -146.51 160.86 40.48 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.324 1.85 . . . . 0.0 110.982 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.88 -12.45 30.79 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.334 2.689 . . . . 0.0 114.074 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -61.53 -38.91 89.15 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.983 -1.073 . . . . 0.0 112.445 173.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -76.54 -20.4 56.91 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.069 0.948 . . . . 0.0 113.309 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.42 -44.58 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 124.653 1.181 . . . . 0.0 110.59 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -61.91 -40.47 95.58 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.698 0.799 . . . . 0.0 112.183 174.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 57.0 mt -65.12 -45.7 93.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.482 0.713 . . . . 0.0 110.843 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.5 -36.0 82.33 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 177.705 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 79.0 t -65.52 -40.93 89.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 120.987 -1.07 . . . . 0.0 110.992 170.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -63.13 -39.96 96.19 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.847 0.859 . . . . 0.0 113.156 176.111 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 44.2 p -76.68 -31.05 57.01 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.798 0.839 . . . . 0.0 112.842 -178.798 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.2 t -61.17 -19.58 61.74 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 173.393 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -54.16 -22.63 11.75 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.539 1.535 . . . . 0.0 113.54 169.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -122.73 10.38 9.63 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.903 1.681 . . . . 0.0 113.144 -175.3 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -66.45 157.33 32.29 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.513 1.125 . . . . 0.0 112.83 175.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.43 -5.1 1.24 Allowed 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 50.6 m -135.55 4.47 3.11 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.347 1.459 . . . . 0.0 113.468 -178.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.9 p90 -161.59 175.18 12.35 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.096 2.158 . . . . 0.0 110.213 -177.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 54.9 ttt85 -147.44 151.75 36.95 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.442 1.497 . . . . 0.0 111.17 169.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 49.3 mt -132.46 142.29 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 126.019 1.727 . . . . 0.0 110.091 -175.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.7 pt20 -145.34 171.43 14.61 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.304 1.841 . . . . 0.0 110.137 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 44.7 p -72.18 160.85 31.75 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 120.481 -1.387 . . . . 0.0 112.325 174.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -55.29 -43.01 74.37 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.5 -0.75 . . . . 0.0 111.565 168.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.75 -38.05 89.68 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.888 0.875 . . . . 0.0 113.31 179.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.04 -45.54 93.12 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.424 -0.798 . . . . 0.0 112.072 173.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -61.36 -48.6 80.54 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.51 0.595 . . . . 0.0 111.817 174.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 18.0 t -54.03 -41.59 50.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 124.342 1.057 . . . . 0.0 112.18 175.786 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -70.24 -12.78 69.53 Favored Glycine 0 CA--C 1.54 1.599 0 N-CA-C 115.424 0.93 . . . . 0.0 115.424 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.35 -1.45 6.3 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -20.82 84.57 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 131.266 3.826 . . . . 0.0 115.688 -174.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -61.77 -16.68 51.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.561 1.544 . . . . 0.0 114.351 -174.377 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -75.15 -9.79 58.87 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.344 1.458 . . . . 0.0 114.566 174.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -120.98 127.55 7.04 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.505 1.05 . . . . 0.0 113.391 -175.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -58.31 -25.88 62.39 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.629 1.572 . . . . 0.0 113.7 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -71.57 -8.22 52.61 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.158 1.783 . . . . 0.0 113.977 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 1.1 t -130.09 14.96 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 125.409 1.484 . . . . 0.0 112.166 -169.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -149.2 160.31 43.48 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.509 1.523 . . . . 0.0 113.008 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 50.0 m -76.77 163.13 27.1 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.721 1.208 . . . . 0.0 112.482 172.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -177.53 172.51 45.26 Favored Glycine 0 CA--C 1.541 1.693 0 C-N-CA 124.219 0.914 . . . . 0.0 114.103 173.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.71 155.29 22.54 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 124.373 3.382 . . . . 0.0 114.714 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 50.1 m -60.69 110.22 1.24 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.833 1.253 . . . . 0.0 111.342 172.023 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 64.6 p -146.76 7.29 0.95 Allowed 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -170.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.183 0 C-N-CA 125.425 1.488 . . . . 0.0 112.963 178.53 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.52 0 C5'-C4'-O4' 113.19 2.85 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.469 0 N-CA-C 111.886 -0.486 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 78.0 p -136.67 -2.45 2.16 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 87.4 p -155.8 165.03 37.72 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.682 1.593 . . . . 0.0 111.931 176.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 172.23 174.22 39.47 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.468 1.032 . . . . 0.0 113.776 177.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 88.3 p -156.92 168.42 27.53 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.452 1.501 . . . . 0.0 112.294 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 37.3 m -133.94 10.19 3.9 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.237 1.415 . . . . 0.0 113.301 -177.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 169.76 -171.64 43.38 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 125.755 1.645 . . . . 0.0 112.595 -176.416 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -167.8 171.93 42.42 Favored Glycine 0 CA--C 1.539 1.587 0 C-N-CA 124.053 0.835 . . . . 0.0 114.004 175.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -53.05 132.9 49.9 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 124.588 3.525 . . . . 0.0 114.635 -178.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -143.73 4.55 1.33 Allowed 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 173.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -64.16 176.57 0.98 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.284 1.834 . . . . 0.0 113.61 169.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -134.42 146.11 58.01 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.871 1.668 . . . . 0.0 110.003 169.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.06 126.65 12.02 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 122.99 2.46 . . . . 0.0 112.809 -171.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -154.81 176.35 12.59 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.818 2.047 . . . . 0.0 110.743 170.635 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 86.9 mmt-85 -135.97 -6.76 2.11 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -174.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -67.35 -2.72 6.56 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 177.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 37.2 p-80 -117.3 12.86 14.45 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.322 1.849 . . . . 0.0 113.06 175.041 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 45.2 t -116.43 125.81 73.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.635 1.174 . . . . 0.0 111.849 -169.672 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.72 167.97 11.31 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.91 1.684 . . . . 0.0 111.693 169.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -128.13 136.68 51.48 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 127.052 2.141 . . . . 0.0 106.806 166.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 11.6 t -132.98 136.86 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.606 1.163 . . . . 0.0 109.131 -169.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 19.0 m -125.89 134.1 51.7 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.055 1.342 . . . . 0.0 109.423 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.9 p90 -156.78 156.98 30.58 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 124.362 1.065 . . . . 0.0 112.462 -168.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.24 145.22 67.18 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.548 2.832 . . . . 0.0 112.193 168.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -55.71 -22.96 26.17 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.362 1.615 . . . . 0.0 115.362 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.71 -12.86 61.42 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.398 1.479 . . . . 0.0 114.329 177.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -70.34 156.31 39.48 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.371 1.068 . . . . 0.0 113.115 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -131.82 170.23 15.13 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.387 1.875 . . . . 0.0 111.727 174.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.3 m -48.17 -37.84 16.63 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.199 1.8 . . . . 0.0 111.857 169.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.7 m -62.31 -45.25 94.07 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -64.56 -30.7 71.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.264 0.626 . . . . 0.0 111.529 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 77.1 mt -72.82 -46.45 53.05 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.853 0.861 . . . . 0.0 111.867 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -61.82 -31.9 72.17 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.774 -1.204 . . . . 0.0 112.809 170.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -69.9 -35.82 74.92 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.095 0.862 . . . . 0.0 112.787 172.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.1 -32.74 74.6 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.754 1.222 . . . . 0.0 112.251 175.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -114.02 13.41 18.19 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 -174.032 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 90.6 p -56.91 -26.37 59.01 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 178.938 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.48 -21.96 60.87 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.312 1.445 . . . . 0.0 114.466 174.657 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -92.98 -2.44 55.75 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.785 1.234 . . . . 0.0 113.703 177.008 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 78.84 -45.21 2.68 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 125.911 1.72 . . . . 0.0 114.248 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -145.54 151.31 37.94 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.649 1.58 . . . . 0.0 111.416 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 19.9 pt -149.36 178.94 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 127.28 2.232 . . . . 0.0 110.258 173.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -141.96 144.61 33.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.152 1.381 . . . . 0.0 109.007 167.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 66.0 mt -123.79 137.55 56.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.897 0.879 . . . . 0.0 110.585 -169.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 69.5 m -135.17 95.28 3.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.184 1.794 . . . . 0.0 109.932 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -58.86 152.25 19.74 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.996 0.919 . . . . 0.0 113.233 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 39.2 pt -134.74 -20.94 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.679 1.192 . . . . 0.0 113.524 172.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -153.32 175.6 12.92 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.649 1.179 . . . . 0.0 111.686 173.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -64.8 -13.34 55.21 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.803 1.641 . . . . 0.0 113.569 174.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 42.0 p -133.97 3.16 3.44 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.684 1.594 . . . . 0.0 113.928 -174.067 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 51.8 p -154.86 157.24 37.54 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 171.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.29 157.2 39.77 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.542 1.537 . . . . 0.0 111.831 -175.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -89.83 149.26 22.75 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.457 0.703 . . . . 0.0 110.176 167.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 42.6 t -138.17 111.12 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 124.135 0.974 . . . . 0.0 110.57 -179.485 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 58.5 m -75.81 139.05 41.56 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.355 1.462 . . . . 0.0 111.059 171.206 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 45.7 mt -113.15 159.7 18.99 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.178 1.391 . . . . 0.0 111.436 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 68.3 m -67.17 -26.38 66.61 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -143.09 147.11 39.68 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 124.876 1.271 . . . . 0.0 111.889 176.161 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.1 -33.13 82.64 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 123.896 3.064 . . . . 0.0 114.716 173.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.9 -29.5 70.25 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.178 -0.951 . . . . 0.0 113.175 178.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.69 -24.68 64.53 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.155 0.982 . . . . 0.0 112.51 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 66.4 t -62.37 -43.24 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.233 1.013 . . . . 0.0 110.539 175.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -63.44 -39.51 94.66 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.654 0.782 . . . . 0.0 111.894 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 82.6 mt -63.79 -47.39 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.913 0.885 . . . . 0.0 110.645 176.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.24 -39.86 94.81 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.62 -43.08 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.466 0.706 . . . . 0.0 111.324 173.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -62.98 -46.76 86.16 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.022 0.828 . . . . 0.0 112.678 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 29.9 p -74.33 -20.3 60.15 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -175.54 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 25.5 p -57.8 -24.81 59.06 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 173.694 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -56.49 -20.45 20.26 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.694 1.998 . . . . 0.0 114.016 174.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -109.36 4.79 22.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.312 1.445 . . . . 0.0 113.689 -174.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -64.9 159.69 22.2 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.03 0.932 . . . . 0.0 113.136 176.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -138.43 -2.46 1.79 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.009 1.324 . . . . 0.0 114.051 174.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 76.1 p -148.64 5.95 0.71 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.172 1.389 . . . . 0.0 114.364 -172.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -158.99 173.25 16.79 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.479 1.912 . . . . 0.0 110.741 -178.753 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -140.83 154.98 46.45 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.171 1.788 . . . . 0.0 110.982 169.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 62.0 mt -135.93 142.68 38.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.952 1.701 . . . . 0.0 109.058 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -149.96 173.68 13.54 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.222 1.809 . . . . 0.0 110.661 172.593 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 37.6 p -74.65 163.36 27.81 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 120.713 -1.242 . . . . 0.0 112.248 172.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -55.86 -42.02 75.25 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.285 -0.885 . . . . 0.0 112.053 169.25 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.63 91.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.113 0.965 . . . . 0.0 113.27 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -62.79 -43.67 98.18 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.437 -0.789 . . . . 0.0 112.133 172.843 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -60.96 -48.06 83.54 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.699 0.681 . . . . 0.0 111.985 175.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 9.3 t -52.37 -37.7 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.487 1.115 . . . . 0.0 113.023 178.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -78.06 -46.56 9.19 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 121.796 -0.565 . . . . 0.0 113.257 177.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -73.34 -24.32 60.35 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 -176.754 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -58.66 -30.78 67.59 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.499 1.92 . . . . 0.0 113.504 175.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -71.62 100.56 2.32 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.532 1.533 . . . . 0.0 110.958 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -140.4 161.96 36.45 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.895 1.678 . . . . 0.0 112.496 -172.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -144.29 3.4 1.43 Allowed Glycine 0 CA--C 1.538 1.497 0 C-N-CA 125.538 1.542 . . . . 0.0 114.982 174.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -116.15 -9.82 11.59 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.86 1.664 . . . . 0.0 113.886 -171.418 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -128.98 16.82 6.23 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.073 1.749 . . . . 0.0 112.382 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 36.0 m -129.51 2.04 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 125.515 1.526 . . . . 0.0 114.048 -169.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 54.9 mttp -76.15 -2.63 32.01 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.071 1.349 . . . . 0.0 114.327 176.736 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 87.6 p -141.26 172.68 12.34 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.886 1.674 . . . . 0.0 112.718 -175.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -147.23 66.73 0.4 Allowed Glycine 0 CA--C 1.537 1.412 0 C-N-CA 125.23 1.395 . . . . 0.0 112.802 -175.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.42 -16.97 34.85 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.707 2.938 . . . . 0.0 114.367 -175.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 77.5 p -141.85 2.2 1.54 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.226 1.41 . . . . 0.0 114.439 -175.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 85.5 p -155.79 164.62 38.31 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.51 1.524 . . . . 0.0 112.313 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.257 0 C-N-CA 125.041 1.305 . . . . 0.0 112.852 -179.808 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.726 0 C5'-C4'-O4' 111.923 1.945 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.656 0 N-CA-C 112.048 -0.421 . . . . 0.0 112.048 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 77.4 p -140.65 10.52 2.25 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.261 1.424 . . . . 0.0 114.059 -175.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 14.8 m -75.22 25.2 0.1 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.106 2.162 . . . . 0.0 115.356 -172.854 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -159.68 -178.22 33.48 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.932 1.253 . . . . 0.0 114.538 -175.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 19.8 m -57.9 154.49 12.17 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.628 1.571 . . . . 0.0 114.105 -176.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 5.0 t -134.69 1.24 3.06 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.71 1.374 . . . . 0.0 114.71 -175.503 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 157.54 -36.96 0.55 Allowed Glycine 0 CA--C 1.534 1.247 0 O-C-N 121.331 -0.856 . . . . 0.0 115.146 170.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 165.29 -168.62 39.44 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 118.037 0.919 . . . . 0.0 114.077 -175.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -72.42 2.45 5.09 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 124.664 3.576 . . . . 0.0 114.543 178.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -63.74 1.4 0.62 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.987 2.115 . . . . 0.0 115.466 -179.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.69 11.38 9.12 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 127.188 2.195 . . . . 0.0 113.769 -178.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -58.79 156.25 25.97 Favored Pre-proline 0 CA--C 1.554 1.129 0 C-N-CA 124.906 1.282 . . . . 0.0 113.2 173.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -68.23 171.87 12.01 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 123.956 3.104 . . . . 0.0 114.345 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -139.29 -179.99 6.2 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.331 1.852 . . . . 0.0 112.954 -171.153 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 -137.86 4.07 2.51 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.707 1.603 . . . . 0.0 114.57 -177.29 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -61.49 -15.44 37.82 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.137 1.375 . . . . 0.0 114.346 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -106.42 14.91 26.67 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.263 2.225 . . . . 0.0 113.236 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 30.4 t -120.89 143.97 31.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.824 1.249 . . . . 0.0 111.008 -176.434 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 88.9 mt -117.0 164.52 14.59 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.122 2.169 . . . . 0.0 111.124 177.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -123.04 139.31 54.2 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.734 2.014 . . . . 0.0 107.523 167.401 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.31 140.95 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 124.723 1.209 . . . . 0.0 109.792 -169.211 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 5.0 m -132.54 133.75 44.12 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.119 1.368 . . . . 0.0 109.735 -177.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -158.98 157.86 28.51 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 124.156 0.982 . . . . 0.0 112.332 -169.388 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.49 146.28 43.06 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.876 3.051 . . . . 0.0 113.465 170.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -53.86 -25.2 18.63 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -62.53 -18.9 62.97 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.211 1.804 . . . . 0.0 114.381 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 17.2 m95 -69.42 157.02 37.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.568 1.147 . . . . 0.0 112.961 176.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -129.38 167.52 17.64 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.16 1.784 . . . . 0.0 111.123 173.498 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.2 m -51.98 -33.08 36.35 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.113 1.365 . . . . 0.0 111.901 170.392 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 70.3 m -64.26 -43.3 95.29 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 174.003 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -66.45 -31.5 72.29 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.536 -0.728 . . . . 0.0 111.231 174.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.0 mt -70.9 -42.91 69.33 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.796 0.838 . . . . 0.0 111.428 175.31 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -60.89 -40.98 95.13 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.99 -1.069 . . . . 0.0 111.797 169.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -60.55 -33.3 72.48 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.613 1.097 . . . . 0.0 112.714 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.8 tp -76.23 -30.18 57.82 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.858 1.263 . . . . 0.0 113.86 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -123.65 -13.11 7.56 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 116.662 2.097 . . . . 0.0 116.662 -169.051 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 32.3 t -58.08 -22.19 49.38 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.327 1.421 . . . . 0.0 113.635 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -54.77 -25.83 30.44 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 171.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -86.94 -18.73 30.07 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 177.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 140.22 -159.61 26.19 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.5 1.048 . . . . 0.0 113.496 -179.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -74.77 62.72 1.1 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.401 1.48 . . . . 0.0 112.281 172.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 1.2 pp -59.08 168.55 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 126.862 2.065 . . . . 0.0 113.497 178.617 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -130.74 150.59 51.85 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.934 1.294 . . . . 0.0 110.648 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 61.5 mt -130.97 133.19 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.217 1.407 . . . . 0.0 109.077 -174.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 45.9 m -134.94 98.21 3.95 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.387 1.475 . . . . 0.0 111.135 -177.5 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -57.84 148.52 25.04 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.778 1.231 . . . . 0.0 113.942 178.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 33.0 pt -135.36 -19.26 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.059 1.343 . . . . 0.0 113.872 170.749 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -152.88 176.93 11.3 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.776 1.231 . . . . 0.0 111.597 172.599 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -64.95 -12.54 50.84 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.895 1.678 . . . . 0.0 113.51 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.7 p -136.97 5.56 2.82 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.225 2.21 . . . . 0.0 113.234 -173.768 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 75.2 m -146.38 138.59 25.05 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.421 1.088 . . . . 0.0 113.156 -172.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.76 157.79 41.34 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.679 1.192 . . . . 0.0 112.398 176.757 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -89.9 154.84 19.55 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.755 0.822 . . . . 0.0 110.027 167.255 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.4 t -137.67 124.3 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.359 1.064 . . . . 0.0 110.15 175.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 7.5 t -93.8 132.71 37.93 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.785 1.234 . . . . 0.0 110.751 177.182 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 50.4 mt -111.85 161.1 16.72 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.352 1.461 . . . . 0.0 111.129 178.265 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 38.5 m -67.79 -25.92 65.83 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -174.143 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -145.55 153.98 52.0 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.187 1.395 . . . . 0.0 111.963 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.17 -20.85 32.36 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.23 2.62 . . . . 0.0 113.632 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -63.17 -35.3 79.83 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.79 -1.194 . . . . 0.0 111.818 171.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -69.35 -28.14 65.95 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.267 -0.896 . . . . 0.0 112.734 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.4 -43.68 98.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.586 0.754 . . . . 0.0 111.151 170.471 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 22.4 tm0? -61.39 -41.62 97.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.75 0.705 . . . . 0.0 111.588 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 95.8 mt -62.19 -47.79 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.368 0.667 . . . . 0.0 111.003 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.79 87.74 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.179 0.9 . . . . 0.0 113.383 178.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.23 -27.6 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.181 0.993 . . . . 0.0 112.117 173.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -74.53 -46.85 36.43 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 120.935 -1.103 . . . . 0.0 112.144 169.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 57.4 p -74.34 -21.23 59.79 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -174.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 84.8 p -59.49 -23.15 62.53 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -59.67 -17.75 36.57 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.198 1.399 . . . . 0.0 114.102 173.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -100.49 -0.48 37.83 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.961 1.305 . . . . 0.0 113.618 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -67.11 155.59 38.34 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.012 0.925 . . . . 0.0 112.943 176.754 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -138.22 -4.22 1.71 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.218 1.407 . . . . 0.0 112.7 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 70.7 p -141.75 5.54 1.78 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.902 1.681 . . . . 0.0 114.1 -172.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -156.68 169.33 24.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.273 1.829 . . . . 0.0 111.055 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 -141.1 149.33 41.44 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.147 2.179 . . . . 0.0 110.411 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 86.8 mt -137.65 142.82 35.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.633 1.573 . . . . 0.0 110.098 -177.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -144.22 164.48 30.6 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.51 1.924 . . . . 0.0 109.566 168.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 20.3 p -71.0 162.05 30.08 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 120.374 -1.454 . . . . 0.0 111.775 174.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -58.17 -36.97 73.81 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.265 -0.897 . . . . 0.0 111.834 169.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.73 92.22 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 123.643 0.777 . . . . 0.0 113.068 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.7 -39.75 95.08 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.379 -0.826 . . . . 0.0 112.029 173.428 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -65.41 -45.43 83.99 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 122.941 0.496 . . . . 0.0 112.067 172.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 6.7 t -57.43 -43.15 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.748 1.219 . . . . 0.0 112.615 176.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -61.9 -27.23 68.26 Favored Glycine 0 CA--C 1.539 1.567 0 CA-C-N 118.244 0.475 . . . . 0.0 113.604 177.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -84.64 -34.32 23.1 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.452 1.501 . . . . 0.0 112.509 172.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -56.81 -25.79 56.57 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 126.337 1.855 . . . . 0.0 113.753 175.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -51.34 -21.21 2.08 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.605 1.562 . . . . 0.0 115.016 176.14 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -59.07 -17.35 25.1 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 115.243 1.572 . . . . 0.0 115.243 170.311 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -151.38 42.72 0.71 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.705 1.621 . . . . 0.0 113.287 -174.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.42 5.51 10.16 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.787 1.635 . . . . 0.0 113.591 -172.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -109.31 -7.95 15.16 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.24 1.416 . . . . 0.0 113.337 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 19.4 m -144.28 163.04 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 126.447 1.899 . . . . 0.0 111.234 -177.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -67.68 -29.96 69.37 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.077 0.951 . . . . 0.0 113.367 175.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 25.5 m -63.74 138.81 58.64 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.206 1.402 . . . . 0.0 112.902 -179.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 148.08 -55.05 0.51 Allowed Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.613 1.101 . . . . 0.0 114.232 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -55.11 153.03 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 124.307 3.338 . . . . 0.0 115.003 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 67.5 p -70.54 -8.28 50.2 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 178.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 61.3 p -67.75 -12.66 61.03 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.102 0 C-N-CA 125.092 1.329 . . . . 0.0 113.056 177.98 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.804 0 O5'-C5'-C4' 113.861 2.615 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.497 0 N-CA-C 112.022 -0.431 . . . . 0.0 112.022 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 19.8 m -63.42 -19.52 64.76 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 -173.639 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 22.6 m -136.78 7.79 3.0 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.984 1.313 . . . . 0.0 114.014 -173.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 169.64 178.0 40.49 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 124.155 0.883 . . . . 0.0 114.287 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 80.7 p -138.41 2.33 2.25 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.43 1.492 . . . . 0.0 114.565 -175.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 2.7 t -143.04 21.97 1.92 Allowed 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.477 1.511 . . . . 0.0 112.586 -178.037 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -174.24 172.08 45.06 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.861 1.696 . . . . 0.0 112.513 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 166.07 -167.28 39.19 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 123.819 0.723 . . . . 0.0 114.155 -174.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -68.45 177.02 5.02 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 124.021 3.148 . . . . 0.0 112.573 173.389 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 22.7 t70 57.89 23.97 10.38 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 126.11 1.764 . . . . 0.0 114.494 -174.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 96.4 mt -127.16 6.23 6.46 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.555 1.942 . . . . 0.0 112.773 177.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 37.48 65.4 2.6 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 127.35 2.26 . . . . 0.0 114.495 -174.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -53.15 -23.58 23.01 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 124.33 3.353 . . . . 0.0 116.449 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -137.29 142.95 41.92 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.151 1.78 . . . . 0.0 110.894 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 69.2 mtt85 -138.92 14.36 2.67 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 126.054 1.742 . . . . 0.0 113.523 174.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.79 -19.75 64.33 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 121.029 -1.044 . . . . 0.0 113.327 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 38.4 p-80 -94.66 12.71 26.76 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.546 2.338 . . . . 0.0 113.795 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 29.3 t -120.11 141.96 37.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.108 1.363 . . . . 0.0 111.656 -171.305 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 65.7 mt -117.13 166.68 11.94 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 127.388 2.275 . . . . 0.0 110.975 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -123.92 142.24 51.32 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 126.779 2.031 . . . . 0.0 107.883 167.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.3 t -134.74 138.6 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 124.999 1.319 . . . . 0.0 109.024 -171.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 3.7 m -125.44 135.79 52.71 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.828 1.251 . . . . 0.0 109.621 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -155.49 153.35 26.36 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 124.689 1.196 . . . . 0.0 112.059 -169.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -52.42 147.51 29.13 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.818 3.012 . . . . 0.0 113.209 169.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -57.95 -18.7 25.14 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.367 1.618 . . . . 0.0 115.367 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -81.27 -15.74 54.64 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.561 1.544 . . . . 0.0 114.0 178.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 6.6 m95 -61.43 151.38 32.72 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.224 0.92 . . . . 0.0 112.323 175.118 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -119.1 165.32 14.31 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.005 1.722 . . . . 0.0 111.869 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.7 m -51.77 -34.57 40.22 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.991 1.316 . . . . 0.0 111.509 168.06 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.8 m -65.99 -41.73 90.7 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 175.405 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -64.98 -31.39 72.6 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.599 -0.688 . . . . 0.0 111.183 173.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 72.8 mt -70.5 -47.41 60.65 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.653 0.781 . . . . 0.0 111.359 174.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -59.91 -32.04 70.38 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.93 -1.106 . . . . 0.0 113.064 171.286 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -69.86 -42.67 73.22 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.148 0.886 . . . . 0.0 112.113 172.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 55.6 tp -62.11 -33.57 74.69 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.162 1.385 . . . . 0.0 112.253 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -108.28 12.91 26.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.663 1.185 . . . . 0.0 113.536 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 23.2 t -56.3 -30.32 62.37 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.026 1.33 . . . . 0.0 113.281 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.64 -14.81 9.25 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.637 1.575 . . . . 0.0 115.081 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -111.26 -4.71 14.86 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.9 1.28 . . . . 0.0 113.684 -175.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 72.86 -31.07 0.75 Allowed Glycine 0 CA--C 1.539 1.556 0 C-N-CA 126.425 1.964 . . . . 0.0 117.196 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -148.07 129.23 14.6 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.862 1.665 . . . . 0.0 110.624 -176.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.8 pt -146.07 173.5 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.556 1.542 . . . . 0.0 112.089 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -142.0 144.5 33.7 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.298 1.439 . . . . 0.0 108.59 167.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 49.7 mt -127.42 133.7 67.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.192 0.997 . . . . 0.0 109.993 -172.057 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 70.6 m -136.9 103.25 5.11 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.551 1.541 . . . . 0.0 110.529 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -60.73 158.85 11.93 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.768 1.227 . . . . 0.0 114.249 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.8 -28.68 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.694 1.197 . . . . 0.0 112.252 171.427 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -154.1 -178.5 7.14 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.878 1.271 . . . . 0.0 111.471 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.74 -19.68 62.7 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.892 1.277 . . . . 0.0 113.065 171.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.8 p -132.31 5.64 4.11 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.99 2.116 . . . . 0.0 113.525 -169.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 18.9 m -144.08 139.88 29.17 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.667 1.187 . . . . 0.0 113.126 -175.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.13 155.2 38.42 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.241 1.416 . . . . 0.0 112.074 174.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -89.4 149.74 22.85 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.421 1.088 . . . . 0.0 109.67 167.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 58.2 t -137.3 115.52 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.281 1.032 . . . . 0.0 110.314 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 67.9 m -80.6 142.51 33.98 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.489 1.116 . . . . 0.0 110.838 170.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 68.6 mt -119.76 160.73 22.02 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.118 1.367 . . . . 0.0 110.843 172.517 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 65.4 m -61.57 -27.45 68.64 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.049 1.5 . . . . 0.0 115.049 -175.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -144.37 152.65 54.27 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.139 1.376 . . . . 0.0 111.573 176.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.24 -12.83 36.22 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.891 3.06 . . . . 0.0 114.032 172.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.5 -38.84 88.12 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.749 -1.219 . . . . 0.0 111.683 169.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -74.62 -25.33 59.16 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.637 0.775 . . . . 0.0 112.788 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.85 -44.15 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.437 1.495 . . . . 0.0 111.179 171.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -65.41 -36.18 83.17 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.014 0.925 . . . . 0.0 112.045 178.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 61.3 mt -64.72 -47.92 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.316 1.047 . . . . 0.0 110.49 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.38 -34.85 79.12 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.8 -41.14 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 O-C-N 121.058 -1.027 . . . . 0.0 111.11 170.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -62.66 -42.58 99.69 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -72.96 -31.38 64.52 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.739 0.816 . . . . 0.0 113.028 -178.209 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 10.3 t -65.04 -16.39 63.39 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 174.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -55.29 -21.88 16.4 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.383 1.473 . . . . 0.0 114.001 176.734 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -124.79 16.41 8.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.78 1.632 . . . . 0.0 112.994 -175.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.22 159.47 17.65 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.293 1.037 . . . . 0.0 113.113 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -135.8 -8.92 2.12 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.027 1.331 . . . . 0.0 113.098 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 71.4 p -140.54 2.43 1.82 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.497 1.519 . . . . 0.0 114.432 -172.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -157.49 176.07 13.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.438 1.895 . . . . 0.0 110.794 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -147.55 147.21 29.86 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.309 1.444 . . . . 0.0 110.827 169.503 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 76.0 mt -129.77 142.05 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 126.237 1.815 . . . . 0.0 109.694 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -146.55 163.14 36.71 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.789 1.636 . . . . 0.0 110.79 170.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 19.2 p -71.1 164.97 24.53 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 120.644 -1.285 . . . . 0.0 112.192 173.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -58.61 -39.4 80.35 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 121.038 -1.039 . . . . 0.0 111.983 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.8 -34.29 78.0 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.802 0.841 . . . . 0.0 113.195 177.344 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -71.84 -40.66 68.91 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.349 -0.845 . . . . 0.0 112.142 170.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -60.71 -36.33 78.53 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.954 1.302 . . . . 0.0 113.559 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 3.2 t -46.4 -37.93 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 125.206 1.402 . . . . 0.0 113.749 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -69.13 -9.09 59.69 Favored Glycine 0 CA--C 1.543 1.821 0 N-CA-C 115.376 0.91 . . . . 0.0 115.376 178.547 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 5.8 mptt -124.74 5.3 8.14 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.904 2.481 . . . . 0.0 113.127 178.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -62.64 -30.98 71.77 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.205 1.802 . . . . 0.0 114.386 -173.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -69.26 157.35 37.13 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.407 1.083 . . . . 0.0 112.806 173.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -138.26 164.79 28.34 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.669 1.588 . . . . 0.0 111.549 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -136.88 23.36 3.22 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.303 1.43 . . . . 0.0 114.429 -175.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -130.61 18.59 5.22 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 126.37 1.868 . . . . 0.0 112.721 -176.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -146.53 130.37 17.14 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.458 1.903 . . . . 0.0 109.83 -176.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 27.6 m -70.05 149.98 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.005 0.922 . . . . 0.0 112.066 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -78.43 -11.32 59.94 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.721 1.208 . . . . 0.0 113.949 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 16.3 m -60.52 160.91 8.22 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.244 1.818 . . . . 0.0 113.497 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -169.89 172.53 43.81 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 124.209 0.909 . . . . 0.0 114.194 176.495 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -79.71 -0.71 10.92 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.774 3.649 . . . . 0.0 114.778 -173.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 58.8 p -65.26 -13.6 58.75 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 91.0 p -150.51 166.89 28.81 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.427 1.491 . . . . 0.0 112.612 175.667 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.229 0 C-N-CA 125.235 1.398 . . . . 0.0 112.816 179.606 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.84 0 C5'-C4'-O4' 113.118 2.798 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.45 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 80.7 p -69.95 168.77 14.63 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.87 1.268 . . . . 0.0 113.514 175.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 25.0 m -132.19 4.15 4.04 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.925 1.29 . . . . 0.0 114.133 -177.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -179.76 24.62 0.04 OUTLIER Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.307 0.956 . . . . 0.0 115.213 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 34.3 p -64.86 -12.71 51.56 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.209 1.559 . . . . 0.0 115.209 -174.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 89.6 p -64.69 -26.11 68.24 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.524 1.129 . . . . 0.0 113.681 170.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 61.36 18.27 55.12 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.796 1.189 . . . . 0.0 114.63 -173.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -178.15 68.47 0.08 OUTLIER Glycine 0 CA--C 1.536 1.361 0 CA-C-N 118.288 1.044 . . . . 0.0 113.569 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.31 -24.76 31.39 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.371 2.714 . . . . 0.0 113.668 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -72.71 140.77 48.05 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.368 1.067 . . . . 0.0 111.626 171.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 95.9 mt -130.57 3.78 4.61 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.692 1.597 . . . . 0.0 113.445 -176.381 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -66.99 158.8 79.75 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 123.83 0.852 . . . . 0.0 112.134 172.675 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -51.23 144.25 30.57 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.725 2.95 . . . . 0.0 113.509 172.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? -82.47 -41.25 20.03 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -176.513 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -141.23 -12.25 0.93 Allowed 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 126.523 1.929 . . . . 0.0 114.89 -172.777 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.9 -17.75 64.87 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -173.609 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 38.1 p-80 -100.17 14.41 30.9 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.434 2.294 . . . . 0.0 113.352 176.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 23.4 t -120.54 133.28 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.665 1.186 . . . . 0.0 111.649 -170.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 94.1 mt -103.81 166.63 10.29 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.842 2.057 . . . . 0.0 111.669 175.691 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -125.32 138.75 54.07 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 127.371 2.268 . . . . 0.0 107.413 167.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.2 t -135.61 138.64 47.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 C-N-CA 124.822 1.249 . . . . 0.0 109.165 -170.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 6.9 m -126.62 131.25 51.52 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.919 1.288 . . . . 0.0 109.23 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -150.51 160.37 32.93 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.678 1.191 . . . . 0.0 112.925 -168.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -54.13 156.59 12.76 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 124.658 3.572 . . . . 0.0 115.32 177.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -58.01 -12.64 3.52 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.396 1.878 . . . . 0.0 115.913 174.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -117.63 -1.03 11.71 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.791 1.636 . . . . 0.0 113.848 -177.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 1.7 m0 -66.81 154.28 41.25 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.223 -0.923 . . . . 0.0 111.874 169.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -129.54 166.47 19.61 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.097 1.359 . . . . 0.0 113.278 -174.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.3 m -47.29 -33.38 5.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.909 1.684 . . . . 0.0 112.865 170.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 20.2 p -72.9 -41.06 65.0 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -60.49 -28.23 68.2 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.551 0.614 . . . . 0.0 110.33 168.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.2 mt -78.36 -46.2 20.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.544 0.338 . . . . 0.0 111.782 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -58.11 -39.64 79.15 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.055 -1.028 . . . . 0.0 111.989 169.676 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -64.37 -34.45 78.18 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.166 0.893 . . . . 0.0 112.869 174.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 44.1 tp -71.52 -28.9 64.21 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.172 0.989 . . . . 0.0 113.141 177.455 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -121.7 3.85 10.08 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 -172.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 75.3 p -56.77 -24.57 51.22 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.12 -15.06 8.17 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.568 1.547 . . . . 0.0 114.624 173.437 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -106.15 3.55 28.09 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.342 1.457 . . . . 0.0 113.861 -177.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 82.55 -45.44 3.38 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.879 1.704 . . . . 0.0 115.572 169.203 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -150.85 143.91 24.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.935 1.294 . . . . 0.0 111.127 177.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 24.1 pt -144.78 171.42 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 125.209 1.404 . . . . 0.0 112.076 -175.583 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -138.33 105.68 5.52 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.244 1.018 . . . . 0.0 109.521 167.197 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.9 mt -74.53 135.72 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.094 0.958 . . . . 0.0 108.477 172.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.7 m -138.99 96.71 3.16 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.503 1.921 . . . . 0.0 109.523 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -58.18 155.94 10.51 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -173.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 8.5 mt -131.72 -41.1 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.177 1.391 . . . . 0.0 110.054 176.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -156.49 179.89 8.83 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.443 1.497 . . . . 0.0 111.441 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -56.23 -20.26 17.52 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.619 1.968 . . . . 0.0 114.087 173.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.6 p -131.42 4.02 4.29 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.273 1.829 . . . . 0.0 113.778 -173.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 69.5 m -144.4 139.42 28.4 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.12 0.968 . . . . 0.0 112.894 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -149.88 152.02 34.39 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.669 1.188 . . . . 0.0 112.24 175.478 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -89.42 151.73 21.87 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.829 0.852 . . . . 0.0 108.788 167.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 49.3 t -140.51 111.14 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.867 0.867 . . . . 0.0 110.591 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 72.4 m -73.84 143.71 45.8 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.796 0.838 . . . . 0.0 110.629 169.386 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 67.3 mt -118.81 164.63 15.12 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.701 1.6 . . . . 0.0 110.516 171.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 63.3 m -62.71 -28.86 70.24 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -144.35 152.75 54.6 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 124.701 1.2 . . . . 0.0 112.346 -177.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.94 -16.67 32.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.457 2.771 . . . . 0.0 113.807 173.434 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.41 -38.48 90.05 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.946 -1.096 . . . . 0.0 111.813 170.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -67.13 -31.04 71.22 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.259 1.024 . . . . 0.0 112.338 179.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 43.4 t -58.28 -40.04 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.986 0.914 . . . . 0.0 111.283 171.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -65.77 -38.37 88.87 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.62 -0.675 . . . . 0.0 111.683 178.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 78.8 mt -65.3 -44.51 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.236 1.014 . . . . 0.0 110.669 175.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.21 -41.14 99.1 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.324 -0.86 . . . . 0.0 112.868 176.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 57.8 t -67.52 -31.56 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.147 0.979 . . . . 0.0 112.303 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -69.4 -49.73 52.61 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.028 -1.045 . . . . 0.0 111.854 171.139 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 23.7 p -71.37 -24.46 62.09 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -174.185 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 60.1 p -67.1 -14.29 62.76 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 176.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -59.88 -16.14 26.88 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.81 1.244 . . . . 0.0 113.734 169.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -119.17 10.95 12.21 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.628 1.571 . . . . 0.0 112.777 -172.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.68 164.24 10.13 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.97 1.308 . . . . 0.0 112.657 170.052 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -136.53 -27.95 1.03 Allowed 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -177.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 42.9 m -133.4 5.65 3.77 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.673 1.189 . . . . 0.0 113.856 -175.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -150.41 176.16 11.18 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.581 1.952 . . . . 0.0 110.468 -176.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -144.27 150.77 38.43 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.547 1.139 . . . . 0.0 111.397 173.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 34.2 mt -133.87 140.1 47.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.345 1.858 . . . . 0.0 108.541 177.572 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -149.65 172.43 15.06 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.101 1.76 . . . . 0.0 110.319 174.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 32.3 p -72.61 163.14 28.54 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.715 -1.241 . . . . 0.0 111.959 171.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -54.54 -41.66 70.02 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.267 -0.896 . . . . 0.0 111.848 169.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.76 -35.76 80.85 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.68 -33.2 73.56 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.024 -1.048 . . . . 0.0 112.926 175.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -67.0 -46.99 72.88 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.721 -0.612 . . . . 0.0 111.813 170.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 24.6 t -59.7 -41.51 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.381 1.072 . . . . 0.0 112.365 174.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -66.66 -38.65 93.39 Favored Glycine 0 CA--C 1.534 1.238 0 O-C-N 121.486 -0.759 . . . . 0.0 113.956 -172.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -16.83 58.13 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 174.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -56.17 -28.71 59.12 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.345 1.458 . . . . 0.0 113.291 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -69.01 -12.43 61.68 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.572 1.549 . . . . 0.0 114.509 174.504 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -127.29 -30.65 2.62 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.642 1.577 . . . . 0.0 113.75 -175.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 110.18 -169.52 13.6 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 125.148 1.356 . . . . 0.0 114.252 174.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -60.69 159.12 11.35 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 125.041 1.336 . . . . 0.0 112.423 173.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -126.78 -7.0 6.17 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.692 1.197 . . . . 0.0 113.956 -176.518 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.5 m -78.7 -15.16 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 124.631 1.172 . . . . 0.0 113.65 175.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -153.31 171.74 18.1 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.895 2.078 . . . . 0.0 111.53 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 44.9 p -150.67 -51.73 0.13 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.329 1.052 . . . . 0.0 112.958 175.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 65.15 -173.73 18.32 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 124.545 1.069 . . . . 0.0 114.859 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -71.88 165.73 31.68 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.771 2.981 . . . . 0.0 112.438 174.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 68.4 m -140.78 149.26 41.85 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.202 1.401 . . . . 0.0 111.871 -178.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 22.8 m -71.81 -16.0 62.16 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -178.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.199 0 C-N-CA 125.738 1.637 . . . . 0.0 113.0 -178.554 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 C5'-C4'-O4' 111.8 1.857 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.65 0 N-CA-C 111.822 -0.511 . . . . 0.0 111.822 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 78.6 p -137.15 -7.73 1.79 Allowed 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -173.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 28.3 p -69.46 -29.94 67.73 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.695 1.198 . . . . 0.0 113.518 174.206 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 153.87 178.71 28.61 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 126.037 1.779 . . . . 0.0 112.508 177.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 25.4 m -59.33 -22.36 61.15 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.18 0.992 . . . . 0.0 113.617 175.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 14.6 m -66.94 -10.57 50.49 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.526 1.93 . . . . 0.0 114.685 173.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -69.84 46.36 0.57 Allowed Glycine 0 CA--C 1.538 1.476 0 C-N-CA 127.588 2.518 . . . . 0.0 116.234 -175.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 169.46 -56.55 0.2 Allowed Glycine 0 CA--C 1.54 1.634 0 C-N-CA 126.265 1.888 . . . . 0.0 113.185 -176.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -80.09 -2.49 12.1 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.593 2.862 . . . . 0.0 114.823 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -140.14 168.25 20.26 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.482 1.113 . . . . 0.0 112.651 -177.636 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 85.5 mt -88.77 156.92 18.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.696 1.598 . . . . 0.0 113.157 -172.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 35.09 52.58 1.49 Allowed Pre-proline 0 CA--C 1.554 1.13 0 C-N-CA 127.713 2.405 . . . . 0.0 116.155 -178.369 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -54.3 -31.32 66.55 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 122.928 2.418 . . . . 0.0 114.535 -177.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -71.28 -3.77 22.27 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.729 2.012 . . . . 0.0 115.813 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 -133.34 -18.73 2.22 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 125.778 1.631 . . . . 0.0 113.844 175.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -63.04 -14.29 46.28 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 177.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -93.62 7.7 43.7 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.701 1.6 . . . . 0.0 114.0 173.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 19.0 t -117.64 139.07 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.711 1.204 . . . . 0.0 111.772 -170.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.7 mt -113.15 166.3 11.57 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.711 2.004 . . . . 0.0 111.537 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -127.72 140.9 51.78 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.526 2.331 . . . . 0.0 107.88 168.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.2 t -136.18 141.04 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.959 1.304 . . . . 0.0 109.498 -169.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 6.7 m -134.14 136.14 43.62 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.724 1.209 . . . . 0.0 109.848 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.7 p90 -158.86 159.04 29.59 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.277 1.031 . . . . 0.0 112.679 -169.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -52.6 147.53 30.27 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 124.225 3.284 . . . . 0.0 114.069 171.319 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -60.72 -12.74 11.41 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 115.854 1.798 . . . . 0.0 115.854 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -75.11 -17.59 60.4 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.879 1.272 . . . . 0.0 113.953 176.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -65.39 154.77 37.43 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -178.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -119.79 164.81 15.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 127.044 2.138 . . . . 0.0 111.697 173.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.6 m -55.81 -31.64 62.85 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.163 0.985 . . . . 0.0 110.908 168.039 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.0 m -64.53 -40.85 96.37 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 172.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -66.49 -30.24 70.53 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.613 -0.679 . . . . 0.0 111.202 173.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 49.7 mt -70.5 -44.81 66.86 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.354 0.662 . . . . 0.0 111.542 173.478 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -57.73 -39.61 77.71 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 120.993 -1.067 . . . . 0.0 111.962 169.531 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 64.3 tp60 -67.82 -33.18 74.28 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.075 0.852 . . . . 0.0 113.257 175.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.5 tp -69.87 -32.02 70.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.467 1.107 . . . . 0.0 112.725 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -115.96 6.02 14.08 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -172.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 79.2 p -58.54 -23.85 59.24 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.941 1.297 . . . . 0.0 114.349 175.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.23 -13.09 4.33 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.622 1.569 . . . . 0.0 114.38 172.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -114.21 5.23 15.8 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.847 1.659 . . . . 0.0 113.304 -176.721 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 72.02 -122.57 9.08 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.473 1.035 . . . . 0.0 112.576 177.493 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -60.64 128.48 36.81 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.412 1.085 . . . . 0.0 111.862 173.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 28.4 pt -142.67 167.52 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.807 1.643 . . . . 0.0 110.894 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -137.98 99.51 3.91 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.155 1.382 . . . . 0.0 110.537 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 56.3 mt -79.74 143.2 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.612 1.565 . . . . 0.0 109.644 177.265 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 7.9 t -141.14 111.61 6.89 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.937 1.295 . . . . 0.0 111.399 175.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -62.39 154.2 28.91 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 7.3 mt -132.68 -44.34 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.982 1.313 . . . . 0.0 110.115 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -153.03 177.38 10.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.326 1.85 . . . . 0.0 109.416 170.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.26 1.13 2.3 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -174.784 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 69.1 p -138.09 5.29 2.54 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 127.259 2.224 . . . . 0.0 113.199 -175.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 88.2 p -154.2 149.36 26.94 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.39 152.48 33.16 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.109 1.364 . . . . 0.0 111.919 -176.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -89.42 153.96 20.43 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 166.739 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 40.6 t -139.54 109.73 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.548 0.739 . . . . 0.0 110.081 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 24.7 m -77.33 132.76 38.75 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.358 1.063 . . . . 0.0 109.53 168.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 77.0 mt -112.35 158.59 19.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.997 1.319 . . . . 0.0 110.516 176.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 58.5 m -68.12 -21.5 64.94 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -174.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -143.28 150.75 52.99 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 124.896 1.278 . . . . 0.0 111.751 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.74 -16.54 37.7 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.463 2.775 . . . . 0.0 113.747 175.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -65.58 -36.51 83.98 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.038 -1.039 . . . . 0.0 112.161 171.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -69.35 -31.88 70.6 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.456 1.102 . . . . 0.0 112.073 -178.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.01 -42.01 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.806 1.242 . . . . 0.0 111.462 171.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 52.8 mm-40 -64.52 -39.17 93.29 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.886 -0.509 . . . . 0.0 111.697 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.98 -48.29 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 124.218 1.007 . . . . 0.0 110.507 177.328 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.52 -36.97 85.54 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.4 t -64.55 -40.14 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 121.188 -0.945 . . . . 0.0 111.194 171.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -63.48 -47.66 80.86 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.774 0.715 . . . . 0.0 112.58 175.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.7 p -69.54 -29.51 67.12 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -175.408 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 11.1 t -62.61 -18.81 62.94 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -60.29 -16.55 35.37 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -123.53 8.17 8.95 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.765 1.626 . . . . 0.0 112.724 -173.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -66.84 155.29 38.7 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.107 1.363 . . . . 0.0 112.74 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -133.61 -9.56 2.81 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.681 1.193 . . . . 0.0 113.994 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 40.4 m -136.87 6.51 2.91 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.205 1.402 . . . . 0.0 113.588 -175.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -160.97 171.84 17.97 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.539 1.936 . . . . 0.0 110.576 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -141.61 151.21 42.92 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.425 1.89 . . . . 0.0 110.451 169.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 62.0 mt -132.7 142.8 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 126.189 1.796 . . . . 0.0 109.6 -179.187 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -144.6 164.47 30.84 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.02 1.728 . . . . 0.0 110.02 169.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 32.6 p -72.0 164.78 25.51 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 120.604 -1.31 . . . . 0.0 112.065 172.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -59.27 -39.37 82.66 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.943 -1.098 . . . . 0.0 112.095 169.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -63.6 -36.91 85.35 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.64 0.776 . . . . 0.0 112.845 176.126 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -66.23 -47.14 74.8 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.424 -0.798 . . . . 0.0 111.854 169.757 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -53.26 -43.02 67.08 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.687 0.676 . . . . 0.0 112.378 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 24.5 t -54.13 -35.04 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.546 1.139 . . . . 0.0 113.195 175.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -90.3 -35.78 7.35 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 123.812 0.72 . . . . 0.0 113.698 179.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -76.1 -1.51 26.37 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.825 1.65 . . . . 0.0 113.921 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 57.5 tttm -56.57 -31.75 64.51 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 126.886 2.074 . . . . 0.0 115.196 -172.013 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 55.44 -179.27 0.04 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.881 2.073 . . . . 0.0 115.041 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -89.88 -7.41 54.3 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.573 1.549 . . . . 0.0 114.836 -170.473 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 80.7 -169.4 52.22 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 124.298 0.951 . . . . 0.0 114.076 -177.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -144.58 141.22 29.29 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.914 1.685 . . . . 0.0 111.177 -176.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.6 mp0 -68.62 147.97 51.15 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.333 1.453 . . . . 0.0 112.294 178.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 40.8 t -135.51 -26.66 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 125.007 1.323 . . . . 0.0 112.599 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -145.96 170.13 17.22 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 126.066 1.746 . . . . 0.0 112.319 -177.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 60.7 p -63.71 -24.09 67.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 -176.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 178.01 171.61 41.59 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 124.622 1.106 . . . . 0.0 113.583 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.37 -26.65 14.16 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.47 2.78 . . . . 0.0 113.627 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 35.5 m 52.34 30.37 7.99 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 126.393 1.877 . . . . 0.0 115.055 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 90.6 p -137.77 3.36 2.48 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.403 1.481 . . . . 0.0 114.643 -174.758 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.252 0 C-N-CA 125.451 1.5 . . . . 0.0 112.943 -178.889 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.698 0 C4'-C3'-O3' 114.235 1.398 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.508 0 N-CA-C 111.956 -0.458 . . . . 0.0 111.956 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 7.6 t -150.97 173.24 14.53 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.087 1.355 . . . . 0.0 111.984 179.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 20.7 t -60.66 138.45 58.07 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.034 0.934 . . . . 0.0 111.654 174.38 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 86.93 -18.64 34.36 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.909 1.243 . . . . 0.0 114.955 -178.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 21.6 m -69.39 -18.6 63.78 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.824 1.312 . . . . 0.0 113.808 175.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 56.4 m -144.93 166.45 25.24 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.551 1.941 . . . . 0.0 111.417 -177.174 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -171.83 178.9 43.84 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 124.671 1.129 . . . . 0.0 113.808 178.789 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 173.62 -51.11 0.15 Allowed Glycine 0 CA--C 1.541 1.714 0 CA-C-O 118.42 -1.211 . . . . 0.0 114.594 -178.774 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -56.15 165.22 4.27 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 124.334 3.356 . . . . 0.0 114.939 173.182 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -143.37 161.91 37.11 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.462 1.505 . . . . 0.0 112.667 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 96.9 mt -142.71 169.64 17.19 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.7 2.0 . . . . 0.0 111.01 -176.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -134.95 127.22 18.17 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 125.071 1.348 . . . . 0.0 110.707 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -82.9 -17.47 6.96 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.433 2.755 . . . . 0.0 114.05 -179.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -65.11 143.96 57.55 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.286 1.435 . . . . 0.0 112.381 -176.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.1 mmt-85 -135.56 -0.81 2.6 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 125.191 1.396 . . . . 0.0 114.4 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -62.36 -23.13 66.63 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.074 0.95 . . . . 0.0 113.492 179.035 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -99.99 12.84 35.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.834 2.054 . . . . 0.0 113.227 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 38.3 t -118.96 137.28 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.746 1.218 . . . . 0.0 111.818 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 61.3 mt -117.33 166.26 12.51 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 127.121 2.168 . . . . 0.0 110.762 175.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -124.46 142.33 51.4 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 127.362 2.265 . . . . 0.0 107.935 168.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 9.2 t -134.03 138.29 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.638 1.175 . . . . 0.0 109.235 -173.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.3 m -123.09 135.16 54.27 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.858 1.263 . . . . 0.0 109.898 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -158.7 157.3 28.4 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.485 1.114 . . . . 0.0 112.512 -170.277 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.18 146.03 73.31 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.783 2.989 . . . . 0.0 112.485 168.423 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -58.44 -18.86 31.75 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 -177.258 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -64.34 -19.25 65.33 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.724 1.209 . . . . 0.0 113.913 175.003 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 16.3 m95 -67.39 162.46 22.95 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.471 1.108 . . . . 0.0 113.151 175.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -143.1 169.92 16.69 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 127.255 2.222 . . . . 0.0 110.947 178.623 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.2 m -51.45 -30.79 20.84 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.292 1.837 . . . . 0.0 112.121 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 14.4 p -74.76 -43.04 56.94 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 177.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -61.15 -26.09 67.46 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.91 -0.494 . . . . 0.0 110.702 169.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 76.1 mt -78.78 -44.51 23.07 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 122.772 0.429 . . . . 0.0 111.477 176.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -57.14 -37.22 71.71 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.029 -1.045 . . . . 0.0 112.143 169.262 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -68.45 -37.75 80.5 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.943 0.897 . . . . 0.0 113.058 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 59.6 tp -68.36 -28.49 67.17 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.328 1.051 . . . . 0.0 112.975 176.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -117.23 8.74 13.27 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -172.01 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 81.8 p -58.14 -27.26 63.61 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.68 -18.23 40.5 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.243 1.417 . . . . 0.0 114.63 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -94.11 0.58 55.94 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.878 1.271 . . . . 0.0 114.267 -177.098 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.97 -45.85 3.39 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.837 1.684 . . . . 0.0 115.182 169.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -150.55 133.83 16.27 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.927 1.291 . . . . 0.0 110.78 175.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 15.4 pt -143.48 171.93 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.468 1.507 . . . . 0.0 111.367 -174.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -138.77 152.14 47.68 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.723 1.609 . . . . 0.0 110.302 169.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 76.2 mt -134.08 139.64 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.082 1.353 . . . . 0.0 109.707 -169.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 7.0 t -144.42 107.24 4.46 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.047 0.939 . . . . 0.0 112.588 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -63.23 148.89 46.87 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 37.0 pt -134.8 -20.93 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.939 1.296 . . . . 0.0 113.714 171.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -153.19 178.77 9.38 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.842 1.257 . . . . 0.0 111.229 173.311 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -66.84 -15.46 63.63 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.59 1.156 . . . . 0.0 112.698 174.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 39.5 p -132.57 8.47 4.22 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.656 1.982 . . . . 0.0 112.976 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 3.7 m -149.34 142.67 25.18 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.564 1.146 . . . . 0.0 113.543 -177.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.29 160.47 43.79 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.514 1.526 . . . . 0.0 111.377 174.446 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -89.34 154.57 19.98 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.808 0.843 . . . . 0.0 110.116 168.425 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 60.9 t -133.8 112.23 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 124.543 1.137 . . . . 0.0 109.164 171.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 37.7 m -85.7 135.11 33.89 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.655 1.582 . . . . 0.0 109.945 172.19 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 79.4 mt -118.64 164.01 15.96 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.973 1.309 . . . . 0.0 111.458 -177.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 58.1 m -69.44 -22.36 63.67 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -177.31 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -146.75 151.32 42.11 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.185 1.394 . . . . 0.0 112.351 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.19 -19.53 33.95 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.481 2.787 . . . . 0.0 113.303 173.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -64.09 -36.27 83.46 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.601 -1.312 . . . . 0.0 111.897 169.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -68.98 -31.7 70.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.061 0.944 . . . . 0.0 112.244 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 86.8 t -57.7 -46.38 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 125.09 1.356 . . . . 0.0 110.753 172.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -63.46 -41.67 98.61 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.263 0.625 . . . . 0.0 112.223 177.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 95.6 mt -62.51 -44.04 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.925 0.89 . . . . 0.0 111.213 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -65.23 -39.45 92.74 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.074 -1.016 . . . . 0.0 113.082 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 80.6 t -65.54 -40.94 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 121.189 -0.944 . . . . 0.0 111.49 174.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -62.01 -48.11 81.78 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.353 1.061 . . . . 0.0 112.533 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 25.4 p -73.16 -27.96 61.96 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.025 0.93 . . . . 0.0 113.151 -175.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.1 t -64.65 -14.91 60.22 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 171.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -60.75 -14.38 20.9 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.686 1.194 . . . . 0.0 113.431 169.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -114.12 8.26 16.92 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.493 1.917 . . . . 0.0 112.871 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.66 160.96 21.57 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.857 1.263 . . . . 0.0 113.122 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.66 -7.82 1.1 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 32.6 m -140.89 8.73 2.12 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.135 1.374 . . . . 0.0 113.631 -178.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 55.6 p90 -160.01 173.89 15.18 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.243 1.817 . . . . 0.0 110.841 -176.402 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -147.73 143.47 27.6 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.036 1.334 . . . . 0.0 110.826 169.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 71.8 mt -120.35 137.18 54.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 126.222 1.809 . . . . 0.0 109.322 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -147.21 169.06 20.15 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.106 1.363 . . . . 0.0 111.293 174.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 43.9 p -71.73 162.66 29.1 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.945 -1.097 . . . . 0.0 112.652 176.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -56.28 -37.08 69.36 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.605 0.762 . . . . 0.0 112.322 169.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -68.02 -40.0 83.02 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.046 0.938 . . . . 0.0 113.152 176.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -67.77 -32.83 73.68 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.045 -1.034 . . . . 0.0 112.505 174.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -63.84 -49.86 71.13 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.064 0.946 . . . . 0.0 111.796 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 8.8 t -53.83 -40.26 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 124.356 1.063 . . . . 0.0 111.954 172.009 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -63.79 -12.36 47.41 Favored Glycine 0 CA--C 1.541 1.708 0 N-CA-C 115.88 1.112 . . . . 0.0 115.88 -178.495 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -115.1 -2.74 12.69 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -54.49 -24.37 20.2 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 125.886 1.674 . . . . 0.0 115.262 -177.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -133.41 20.43 3.98 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.812 1.645 . . . . 0.0 113.055 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -142.4 66.68 1.33 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.596 1.558 . . . . 0.0 110.92 -173.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 164.96 -17.14 0.1 OUTLIER Glycine 0 CA--C 1.537 1.414 0 N-CA-C 116.127 1.211 . . . . 0.0 116.127 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -53.09 -58.63 6.36 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.36 1.464 . . . . 0.0 113.519 -174.127 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -157.49 27.58 0.29 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.851 1.66 . . . . 0.0 111.59 175.812 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 34.4 m -60.05 -17.18 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -173.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -62.89 -22.99 67.13 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.388 1.475 . . . . 0.0 113.772 172.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 77.2 p -126.87 -22.38 3.85 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 174.201 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 101.94 -171.57 21.82 Favored Glycine 0 CA--C 1.54 1.655 0 N-CA-C 116.889 1.516 . . . . 0.0 116.889 167.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -51.81 -26.22 23.4 Favored 'Trans proline' 0 C--N 1.353 0.773 1 C-N-CA 125.604 4.203 . . . . 0.0 116.745 -175.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 72.8 p -62.63 -16.3 56.08 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 174.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 58.2 m -131.64 2.98 4.15 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.805 1.642 . . . . 0.0 113.72 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.246 0 CA-C-O 118.193 -1.337 . . . . 0.0 113.261 179.207 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 C5'-C4'-C3' 111.264 -2.824 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.404 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 50.3 m -143.8 164.59 30.06 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.226 1.41 . . . . 0.0 112.083 -174.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.4 t -149.88 160.33 43.67 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.301 1.44 . . . . 0.0 111.418 176.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 138.27 -13.49 3.52 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.209 1.385 . . . . 0.0 114.889 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 78.3 p -129.56 1.47 5.0 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.519 1.528 . . . . 0.0 114.415 -172.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 59.2 p -72.79 -12.39 60.98 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.4 1.48 . . . . 0.0 114.326 173.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -78.17 -173.31 41.38 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 125.425 1.488 . . . . 0.0 114.484 177.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -172.83 -172.34 38.4 Favored Glycine 0 CA--C 1.54 1.606 0 C-N-CA 124.881 1.229 . . . . 0.0 113.527 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -75.18 53.34 3.38 Favored 'Trans proline' 0 CA--C 1.549 1.264 1 C-N-CA 125.447 4.098 . . . . 0.0 112.909 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -60.54 157.39 14.34 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.786 1.634 . . . . 0.0 113.162 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 3.6 pp -62.71 164.64 7.49 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.749 1.22 . . . . 0.0 114.268 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -138.11 91.51 12.99 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 125.739 1.616 . . . . 0.0 109.804 -175.432 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -74.15 163.35 36.8 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.151 2.567 . . . . 0.0 112.527 -175.504 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -71.3 26.83 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 126.386 1.874 . . . . 0.0 114.843 175.105 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 78.7 mtm-85 50.35 36.85 13.89 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 126.995 2.118 . . . . 0.0 113.912 -170.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -63.95 -16.36 61.35 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.466 1.107 . . . . 0.0 113.521 174.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -89.12 11.0 19.79 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.912 2.085 . . . . 0.0 113.83 172.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 44.1 t -121.96 137.23 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 125.169 1.388 . . . . 0.0 110.734 -176.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.7 mt -98.73 162.67 12.99 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 125.871 1.668 . . . . 0.0 111.95 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -118.34 138.45 52.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 127.658 2.383 . . . . 0.0 106.287 166.335 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.8 t -136.33 139.98 44.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 124.233 1.013 . . . . 0.0 109.417 -169.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.7 m -131.24 134.04 46.05 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.18 1.392 . . . . 0.0 109.699 -178.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -157.5 158.43 30.65 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 124.273 1.029 . . . . 0.0 112.504 -169.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -55.81 144.76 75.67 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.318 2.679 . . . . 0.0 111.923 168.785 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -55.39 -24.4 29.71 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 115.316 1.598 . . . . 0.0 115.316 -176.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -63.15 -21.21 66.05 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.149 1.379 . . . . 0.0 113.782 178.008 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 13.4 m95 -63.69 152.74 38.27 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.081 0.953 . . . . 0.0 112.547 174.533 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 43.2 mttm -133.56 171.82 13.57 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.211 1.804 . . . . 0.0 111.653 176.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.1 m -50.62 -35.01 28.36 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.341 1.456 . . . . 0.0 112.338 172.13 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.5 m -65.07 -42.4 94.2 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 175.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.12 -31.45 72.32 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.623 -0.673 . . . . 0.0 111.246 174.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 78.1 mt -70.91 -44.51 66.07 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.884 0.874 . . . . 0.0 111.507 175.178 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -57.28 -41.97 80.77 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.24 -0.912 . . . . 0.0 111.938 169.412 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.25 -39.07 92.16 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 118.808 0.731 . . . . 0.0 112.947 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.0 tp -65.98 -35.05 79.53 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.618 1.167 . . . . 0.0 112.398 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -111.71 5.83 19.45 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -173.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 24.5 t -53.63 -30.64 43.77 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.399 1.479 . . . . 0.0 113.515 173.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.6 -12.15 3.79 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 125.778 1.631 . . . . 0.0 115.129 175.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -113.53 3.08 15.58 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.662 1.585 . . . . 0.0 113.534 -177.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 93.74 -151.62 20.39 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.476 1.036 . . . . 0.0 112.686 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -62.28 150.75 38.34 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.584 0.754 . . . . 0.0 112.286 170.148 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 27.4 pt -144.76 179.21 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 126.061 1.744 . . . . 0.0 111.245 -174.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -137.95 143.53 40.78 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.81 1.244 . . . . 0.0 109.338 168.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.9 mt -127.5 130.99 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.723 1.209 . . . . 0.0 109.456 -171.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 63.7 m -137.58 98.94 3.81 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.447 1.499 . . . . 0.0 110.993 -174.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 94.9 m95 -57.94 152.44 16.23 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.508 1.123 . . . . 0.0 113.923 179.301 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 36.5 pt -134.05 -22.31 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.778 1.231 . . . . 0.0 113.401 169.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -154.1 178.2 10.23 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.395 1.078 . . . . 0.0 111.982 174.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -66.23 -14.57 62.14 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.756 1.622 . . . . 0.0 113.189 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.2 p -132.76 8.09 4.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.261 1.824 . . . . 0.0 113.434 -175.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 58.0 p -156.75 151.98 26.41 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.84 162.08 41.52 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.656 1.582 . . . . 0.0 112.051 -177.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -94.61 150.58 20.09 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.13 0.972 . . . . 0.0 110.124 167.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 47.5 t -138.99 113.79 8.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.318 1.047 . . . . 0.0 110.848 177.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 50.9 m -76.48 136.22 39.37 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.963 1.305 . . . . 0.0 111.466 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 74.0 mt -118.57 163.92 16.07 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.582 1.553 . . . . 0.0 110.236 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 50.9 m -69.6 -23.45 63.52 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -174.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -148.19 146.39 23.13 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.752 1.221 . . . . 0.0 112.959 -176.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.69 -29.99 73.49 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.786 2.99 . . . . 0.0 114.177 168.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.0 mp0 -60.89 -37.21 81.4 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.944 -1.097 . . . . 0.0 112.073 174.191 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -70.19 -36.38 74.58 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.379 -0.826 . . . . 0.0 111.62 175.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 15.1 t -58.86 -47.84 88.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.708 0.803 . . . . 0.0 111.223 170.255 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.72 -41.33 90.6 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.519 0.599 . . . . 0.0 112.255 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 82.8 mt -62.56 -50.55 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.479 0.712 . . . . 0.0 110.983 174.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.92 -36.28 82.85 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 62.6 t -65.35 -41.0 90.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.386 -0.821 . . . . 0.0 111.048 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -64.1 -45.63 87.77 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.14 0.882 . . . . 0.0 112.814 175.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 49.1 p -72.09 -22.07 61.4 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 25.1 p -60.14 -17.33 39.67 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 175.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -52.82 -22.97 6.02 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.506 1.922 . . . . 0.0 113.717 169.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -123.9 20.51 9.2 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.993 1.717 . . . . 0.0 112.715 -175.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.79 -37.75 88.55 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 52.91 -20.68 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 130.014 3.326 . . . . 0.0 118.819 -176.274 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 51.1 m -136.2 3.63 2.88 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.4 1.48 . . . . 0.0 114.027 -173.3 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -156.42 177.72 11.14 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.103 2.161 . . . . 0.0 109.85 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -143.76 150.22 38.27 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.929 1.292 . . . . 0.0 111.022 175.582 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 92.0 mt -129.52 145.37 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.554 1.542 . . . . 0.0 110.079 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -141.16 170.19 16.19 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.799 2.44 . . . . 0.0 108.731 172.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 31.9 p -79.29 163.92 24.53 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.495 -1.378 . . . . 0.0 110.069 167.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -55.95 -43.32 77.35 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.378 -0.826 . . . . 0.0 111.678 169.214 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -67.85 -38.88 83.7 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -62.64 -38.97 92.36 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.534 1.534 . . . . 0.0 111.769 176.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -67.88 -50.8 54.3 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.318 0.647 . . . . 0.0 112.436 170.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 6.2 t -51.6 -41.5 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.885 1.274 . . . . 0.0 113.186 -177.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -64.93 -11.49 50.99 Favored Glycine 0 CA--C 1.542 1.758 0 N-CA-C 115.47 0.948 . . . . 0.0 115.47 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.1 ptpp? -137.35 11.82 3.01 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.45 1.9 . . . . 0.0 114.576 -178.863 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -49.85 -17.16 0.33 Allowed 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 118.354 2.724 . . . . 0.0 118.354 -169.356 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -60.19 -22.69 63.26 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.442 1.097 . . . . 0.0 112.666 168.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -140.42 -177.93 5.26 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 127.775 2.43 . . . . 0.0 111.102 176.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 179.7 177.96 48.18 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 121.597 -0.689 . . . . 0.0 113.975 177.169 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -61.53 151.2 33.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.94 1.296 . . . . 0.0 111.578 174.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -148.78 151.27 34.51 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.959 1.703 . . . . 0.0 109.442 171.342 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.5 m -132.95 -7.93 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 -169.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -64.6 -10.86 29.38 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 173.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 13.3 m -70.6 17.34 0.07 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.993 2.517 . . . . 0.0 116.321 -171.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -159.46 174.7 36.37 Favored Glycine 0 CA--C 1.539 1.593 0 O-C-N 120.843 -1.161 . . . . 0.0 114.122 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -72.74 164.76 34.67 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 124.137 3.225 . . . . 0.0 113.414 -175.598 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 42.8 m -134.13 9.91 3.83 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.492 1.517 . . . . 0.0 113.434 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 54.8 p -71.39 -15.48 62.37 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.376 1.47 . . . . 0.0 114.947 -178.602 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.196 0 C-N-CA 125.523 1.535 . . . . 0.0 112.722 178.75 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.612 0 C5'-C4'-O4' 112.885 2.632 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.051 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 67.4 m -143.95 157.8 44.11 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.559 1.544 . . . . 0.0 111.772 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 34.3 m -137.65 6.5 2.72 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -171.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 177.92 -177.3 48.34 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.379 0.99 . . . . 0.0 114.007 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 80.3 p -137.18 4.67 2.72 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.539 1.536 . . . . 0.0 114.368 -174.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 8.5 t -153.14 173.34 15.62 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.018 1.727 . . . . 0.0 111.083 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -170.52 174.81 44.5 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.263 0.935 . . . . 0.0 114.677 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 173.21 -175.99 45.99 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 125.859 1.695 . . . . 0.0 112.219 -177.023 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -66.31 -12.94 37.72 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.652 2.901 . . . . 0.0 114.422 -178.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.43 -5.03 25.49 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.545 1.538 . . . . 0.0 114.347 171.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 92.1 mt -130.93 125.13 32.67 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.856 2.062 . . . . 0.0 109.438 178.213 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -137.36 74.73 47.31 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 124.612 1.165 . . . . 0.0 110.906 -168.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -71.53 169.15 21.66 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 124.094 3.196 . . . . 0.0 113.355 -178.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -134.76 171.88 13.74 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.667 1.987 . . . . 0.0 111.231 -178.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -124.34 -4.92 7.79 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 126.302 1.841 . . . . 0.0 113.771 176.062 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -65.73 -21.91 66.56 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.238 1.015 . . . . 0.0 113.684 -176.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 -95.0 12.99 26.49 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.425 1.89 . . . . 0.0 113.672 176.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 38.2 t -116.98 134.12 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.422 1.089 . . . . 0.0 111.362 -170.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 89.8 mt -102.2 164.96 11.4 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.593 1.957 . . . . 0.0 111.24 174.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -124.05 138.04 54.5 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 127.196 2.198 . . . . 0.0 107.34 167.657 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -135.42 138.49 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.695 1.198 . . . . 0.0 109.387 -169.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 10.1 m -127.05 136.03 51.63 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.221 1.408 . . . . 0.0 109.501 -177.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -159.91 158.93 27.3 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 124.128 0.971 . . . . 0.0 113.131 -168.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -58.02 146.42 87.48 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.464 2.776 . . . . 0.0 111.346 167.241 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.62 -21.29 38.47 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -175.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -62.44 -22.47 66.22 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.697 1.599 . . . . 0.0 113.985 174.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.0 m95 -62.96 148.91 46.14 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 122.07 0.938 . . . . 0.0 113.068 173.586 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 25.4 mtmm -132.73 166.19 22.78 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.457 1.903 . . . . 0.0 111.377 -172.873 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.5 m -52.75 -33.68 49.34 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.406 1.083 . . . . 0.0 111.837 169.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 75.5 m -66.61 -45.88 77.69 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.492 1.117 . . . . 0.0 113.912 173.081 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.54 -34.49 77.91 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.508 -0.745 . . . . 0.0 111.079 175.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 77.3 mt -67.42 -43.86 80.18 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.251 1.02 . . . . 0.0 111.278 173.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.48 -42.09 86.72 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.112 -0.993 . . . . 0.0 112.507 170.67 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -64.97 -30.53 71.53 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.168 0.894 . . . . 0.0 113.191 175.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 51.6 tp -74.51 -29.88 61.58 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.554 1.142 . . . . 0.0 113.262 175.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -122.01 -4.34 9.05 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -169.811 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 83.0 p -57.96 -23.27 53.0 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 120.064 1.302 . . . . 0.0 114.256 174.053 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.13 -14.63 7.25 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.64 1.576 . . . . 0.0 114.345 171.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -109.86 3.07 20.29 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.888 1.675 . . . . 0.0 113.309 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 101.87 -158.53 18.43 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.822 1.201 . . . . 0.0 112.801 -176.6 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -63.53 152.89 37.33 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.428 0.691 . . . . 0.0 112.199 170.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 31.4 pt -143.93 174.64 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.485 1.514 . . . . 0.0 111.659 -173.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -137.24 151.57 48.88 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.433 1.493 . . . . 0.0 110.177 168.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 71.5 mt -136.17 131.19 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 124.479 1.112 . . . . 0.0 110.303 -169.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 51.7 m -137.54 103.73 5.13 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.131 1.772 . . . . 0.0 109.763 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 61.4 m95 -75.32 160.44 30.32 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.54 -0.725 . . . . 0.0 112.852 -174.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 29.9 pt -135.48 -18.94 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.807 1.243 . . . . 0.0 113.677 175.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -151.65 179.05 8.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.651 1.18 . . . . 0.0 111.737 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -69.23 -10.8 59.48 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.563 1.545 . . . . 0.0 113.05 170.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 39.9 p -135.43 3.34 3.06 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.839 1.656 . . . . 0.0 113.929 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 89.1 p -155.15 155.37 33.83 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 170.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -154.15 160.37 41.86 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.195 1.398 . . . . 0.0 112.473 -176.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -91.76 148.88 21.92 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.907 0.883 . . . . 0.0 110.675 168.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 48.8 t -136.42 111.78 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.808 1.243 . . . . 0.0 110.28 178.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 69.8 m -79.07 115.57 18.83 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.666 1.586 . . . . 0.0 110.575 173.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 65.7 mt -82.73 163.61 21.19 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.384 0.673 . . . . 0.0 111.02 169.48 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 87.5 p -67.47 -21.57 65.52 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 176.608 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -147.76 145.03 20.03 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.445 1.498 . . . . 0.0 111.691 -177.528 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -71.54 -18.07 29.59 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.411 2.741 . . . . 0.0 113.372 172.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -62.45 -26.9 68.76 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.043 -1.036 . . . . 0.0 112.789 172.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -92.97 -17.62 23.71 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.546 1.138 . . . . 0.0 113.012 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 28.9 t -57.39 -45.28 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.748 1.219 . . . . 0.0 110.973 171.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -61.73 -34.59 76.09 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.47 0.708 . . . . 0.0 112.753 177.218 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 47.6 mt -68.23 -46.09 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.613 0.765 . . . . 0.0 110.367 178.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.73 -40.67 97.91 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.432 -0.792 . . . . 0.0 112.725 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 73.1 t -67.98 -32.31 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.014 0.926 . . . . 0.0 112.441 175.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -68.96 -47.91 64.47 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.099 -1.001 . . . . 0.0 112.07 171.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 24.3 p -76.23 -22.81 54.77 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -172.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 55.8 p -61.17 -18.23 57.07 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 175.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -55.59 -19.84 11.59 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.015 1.726 . . . . 0.0 113.601 169.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -122.99 18.76 10.09 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.14 1.776 . . . . 0.0 112.671 -175.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -60.62 162.94 5.9 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.522 1.529 . . . . 0.0 113.913 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -129.74 -15.21 3.96 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -171.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 14.9 t -154.95 10.93 0.35 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.034 1.334 . . . . 0.0 112.75 -176.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -158.07 175.39 13.86 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.124 1.37 . . . . 0.0 111.913 -169.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -145.6 152.44 39.68 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.961 1.704 . . . . 0.0 110.402 169.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 42.2 mt -136.17 142.71 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.44 1.496 . . . . 0.0 110.317 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -146.9 169.13 19.79 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.852 2.061 . . . . 0.0 109.808 169.624 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 16.8 p -71.8 164.63 25.65 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 120.038 -1.664 . . . . 0.0 112.404 171.758 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -56.28 -42.25 77.18 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.105 -0.997 . . . . 0.0 111.856 169.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.39 87.19 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.687 0.795 . . . . 0.0 112.94 177.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -64.37 -41.37 96.73 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.352 -0.843 . . . . 0.0 111.965 172.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -58.61 -49.59 76.93 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.973 0.806 . . . . 0.0 111.677 172.72 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 37.6 t -56.52 -44.29 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.071 0.949 . . . . 0.0 111.934 176.378 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -75.19 -9.29 84.11 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 124.275 0.94 . . . . 0.0 115.383 -178.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -125.71 10.48 7.76 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 126.533 1.933 . . . . 0.0 113.16 -177.444 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -62.1 -19.47 63.02 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.532 1.933 . . . . 0.0 114.837 -173.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 29.5 mp0 -56.74 138.45 52.97 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.686 1.595 . . . . 0.0 112.297 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -65.2 128.42 35.74 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.255 1.022 . . . . 0.0 111.311 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 169.17 50.79 0.03 OUTLIER Glycine 0 CA--C 1.534 1.22 0 C-N-CA 123.906 0.765 . . . . 0.0 113.408 -173.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -138.18 167.2 22.33 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.47 1.508 . . . . 0.0 113.196 -171.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 50.2 tp60 -148.59 151.16 34.56 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.074 1.75 . . . . 0.0 110.374 -179.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.0 m -72.82 1.84 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 115.178 1.548 . . . . 0.0 115.178 -177.685 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -53.67 137.66 36.79 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.892 1.677 . . . . 0.0 112.409 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 8.7 t -152.57 173.58 15.0 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.403 1.481 . . . . 0.0 111.753 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 175.16 -49.02 0.13 Allowed Glycine 0 CA--C 1.54 1.612 0 C-N-CA 125.006 1.288 . . . . 0.0 114.88 -179.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -59.59 -24.36 74.87 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.925 3.083 . . . . 0.0 116.156 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 50.3 m -60.19 148.15 37.32 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.826 1.25 . . . . 0.0 113.342 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 52.3 m -83.09 -0.4 48.92 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -175.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.236 0 C-N-CA 125.94 1.733 . . . . 0.0 113.391 179.715 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.68 0 C5'-C4'-O4' 112.533 2.381 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.551 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 56.4 p -53.51 -25.41 16.56 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 125.262 1.425 . . . . 0.0 114.288 176.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 33.2 p -53.79 -15.29 1.21 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 127.195 2.198 . . . . 0.0 115.355 169.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -149.78 23.86 1.17 Allowed Glycine 0 CA--C 1.537 1.463 0 C-N-CA 125.193 1.377 . . . . 0.0 114.919 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 76.7 p -141.33 -0.05 1.46 Allowed 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -177.736 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 95.7 p -146.24 170.2 17.23 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.241 1.016 . . . . 0.0 113.401 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -175.64 -169.92 37.88 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 125.625 1.583 . . . . 0.0 112.838 -175.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -169.36 -175.64 38.72 Favored Glycine 0 CA--C 1.543 1.783 0 C-N-CA 124.012 0.815 . . . . 0.0 114.705 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -52.99 163.94 1.87 Allowed 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 125.227 3.951 . . . . 0.0 115.549 177.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -145.41 163.98 32.93 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.268 1.427 . . . . 0.0 111.979 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.75 178.08 2.75 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.265 1.826 . . . . 0.0 113.472 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 52.87 58.44 14.4 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 126.747 2.019 . . . . 0.0 115.136 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -66.31 166.29 21.86 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.205 2.604 . . . . 0.0 112.325 171.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 37.8 tttm -130.72 27.25 4.97 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.149 1.379 . . . . 0.0 113.507 -170.272 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -126.88 2.88 6.63 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.107 1.763 . . . . 0.0 114.168 -178.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.33 -12.72 44.86 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.082 1.353 . . . . 0.0 114.298 -178.394 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -115.28 13.46 16.67 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.187 2.195 . . . . 0.0 113.062 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 54.7 t -114.24 125.02 71.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.606 1.162 . . . . 0.0 111.153 -170.549 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.6 mt -92.23 164.11 13.67 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.374 1.47 . . . . 0.0 111.79 170.372 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -122.41 134.76 54.6 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 127.19 2.196 . . . . 0.0 106.663 166.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.8 t -130.18 136.36 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 125.111 1.364 . . . . 0.0 109.022 -169.344 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 11.6 m -129.66 135.57 48.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.081 1.353 . . . . 0.0 109.422 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -158.9 158.38 29.04 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 123.904 0.881 . . . . 0.0 112.788 -169.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -56.46 143.23 88.09 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 122.976 2.451 . . . . 0.0 110.82 166.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -58.13 -19.45 32.64 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -176.171 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -61.52 -21.37 64.17 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.171 1.388 . . . . 0.0 113.946 174.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -64.02 151.1 43.83 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.801 0.84 . . . . 0.0 112.541 172.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -136.64 167.66 20.99 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.044 1.738 . . . . 0.0 111.568 179.055 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.9 m -51.62 -36.38 45.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.242 1.417 . . . . 0.0 112.817 177.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 72.5 m -67.63 -39.12 84.67 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 176.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -67.38 -31.7 72.11 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.319 -0.863 . . . . 0.0 110.965 173.63 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.3 mt -71.18 -46.24 61.77 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.068 0.947 . . . . 0.0 111.223 176.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -57.16 -37.87 72.72 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.029 -1.044 . . . . 0.0 112.846 171.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -69.72 -37.41 76.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.092 0.957 . . . . 0.0 113.31 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 66.2 tp -62.83 -34.25 76.93 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.559 1.143 . . . . 0.0 112.233 176.691 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -105.23 5.95 32.53 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 -176.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 21.4 t -54.93 -29.27 55.93 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.908 1.283 . . . . 0.0 113.406 176.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.82 -13.02 5.09 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.81 1.644 . . . . 0.0 115.21 173.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -117.61 5.74 12.41 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.702 1.601 . . . . 0.0 113.168 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 78.19 -148.47 32.9 Favored Glycine 0 CA--C 1.535 1.314 0 O-C-N 121.291 -0.88 . . . . 0.0 112.992 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -59.67 142.5 52.88 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.218 1.007 . . . . 0.0 112.678 177.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 10.2 pt -143.59 177.86 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 126.29 1.836 . . . . 0.0 111.287 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -132.57 144.85 50.67 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.634 1.174 . . . . 0.0 110.048 169.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.1 mt -126.41 131.85 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.157 1.383 . . . . 0.0 109.044 -172.031 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 56.8 m -134.92 96.43 3.52 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.799 1.64 . . . . 0.0 110.755 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -57.46 150.03 19.59 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.256 1.022 . . . . 0.0 113.209 177.326 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 38.1 pt -133.16 -19.13 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.658 1.183 . . . . 0.0 113.237 170.117 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -152.06 170.87 18.87 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.247 1.419 . . . . 0.0 111.785 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -61.46 -17.52 54.83 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.16 1.784 . . . . 0.0 113.097 170.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 72.8 p -130.04 4.1 4.86 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.979 1.712 . . . . 0.0 114.69 -176.631 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 98.7 p -154.74 157.09 37.5 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 174.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.69 163.18 40.16 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.771 1.629 . . . . 0.0 112.207 -177.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -98.26 151.36 20.56 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.425 1.09 . . . . 0.0 110.18 167.818 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 89.6 t -139.32 117.85 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.05 0.94 . . . . 0.0 111.088 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 73.2 m -83.16 116.29 22.29 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.55 1.54 . . . . 0.0 110.581 173.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 64.0 mt -85.65 160.4 19.59 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.169 0.987 . . . . 0.0 111.649 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 93.7 p -73.01 -19.83 61.12 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -142.27 149.14 50.59 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.48 1.512 . . . . 0.0 110.925 174.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -70.25 -23.71 28.26 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.943 2.428 . . . . 0.0 113.645 179.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -63.68 -30.05 71.2 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.944 -1.097 . . . . 0.0 112.679 175.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -69.56 -24.44 63.7 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.09 1.356 . . . . 0.0 112.685 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.69 -47.46 91.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.398 1.079 . . . . 0.0 110.987 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -62.13 -37.94 87.06 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.103 0.561 . . . . 0.0 112.068 177.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 68.0 mt -62.04 -54.72 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.732 0.813 . . . . 0.0 110.143 176.499 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.15 86.13 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -178.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 65.0 t -63.8 -45.09 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.239 -0.913 . . . . 0.0 110.922 172.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.73 -45.93 91.81 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.72 0.808 . . . . 0.0 112.93 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.9 p -70.17 -22.78 62.93 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.269 1.028 . . . . 0.0 113.513 -177.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 47.5 m -90.0 -6.56 55.47 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -177.258 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt -56.41 -16.4 5.7 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 172.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -126.49 9.93 7.22 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.967 1.707 . . . . 0.0 113.035 -173.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.4 156.16 33.14 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.801 1.241 . . . . 0.0 112.795 177.358 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -131.28 -6.74 3.81 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 43.0 m -132.3 1.78 3.83 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.204 1.402 . . . . 0.0 113.511 -177.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 45.8 p90 -163.02 174.39 12.35 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.812 2.445 . . . . 0.0 109.621 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -147.6 148.21 30.88 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.567 1.547 . . . . 0.0 110.868 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 74.7 mt -131.7 144.98 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 125.684 1.593 . . . . 0.0 110.505 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -147.17 170.56 16.97 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.933 2.093 . . . . 0.0 109.87 171.329 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 20.9 p -73.5 162.92 28.72 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.576 -1.328 . . . . 0.0 111.716 172.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -55.1 -41.15 71.24 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.409 -0.807 . . . . 0.0 112.156 169.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -70.02 -38.02 75.78 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 179.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -64.38 -41.27 96.78 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.413 -0.805 . . . . 0.0 111.698 173.661 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -56.11 -50.91 69.73 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.423 0.689 . . . . 0.0 111.791 172.089 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 43.4 t -60.37 -44.31 95.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 124.161 0.984 . . . . 0.0 112.355 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -71.43 -43.09 54.77 Favored Glycine 0 CA--C 1.534 1.262 0 O-C-N 121.725 -0.61 . . . . 0.0 113.454 -174.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -70.59 -22.89 62.51 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.61 1.164 . . . . 0.0 113.475 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -70.32 -10.99 60.57 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.447 1.899 . . . . 0.0 114.379 176.139 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -133.47 170.16 15.91 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.848 1.259 . . . . 0.0 113.885 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -120.81 -34.78 3.49 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.421 1.488 . . . . 0.0 114.572 -172.531 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 135.8 -25.93 3.19 Favored Glycine 0 N--CA 1.478 1.452 0 N-CA-C 116.476 1.35 . . . . 0.0 116.476 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -122.11 3.82 9.85 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 125.006 1.322 . . . . 0.0 113.918 -173.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -56.97 -22.02 34.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.89 1.676 . . . . 0.0 114.124 178.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 27.1 m -66.98 -18.52 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.965 1.706 . . . . 0.0 114.448 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -143.33 1.79 1.24 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -174.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 67.1 p -62.98 -20.31 65.15 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -179.678 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 177.08 179.35 47.4 Favored Glycine 0 CA--C 1.541 1.691 0 C-N-CA 124.846 1.212 . . . . 0.0 113.877 174.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.32 -21.85 46.42 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.59 3.527 . . . . 0.0 115.627 176.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 13.2 t -149.49 171.99 15.71 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.095 1.758 . . . . 0.0 111.222 179.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 20.9 m -128.32 5.17 5.74 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.747 1.619 . . . . 0.0 113.724 -172.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.303 0 C-N-CA 125.493 1.52 . . . . 0.0 113.781 177.226 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 0 C5'-C4'-O4' 113.919 3.371 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.522 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 10.5 t -151.96 164.56 36.9 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.196 1.398 . . . . 0.0 111.472 178.111 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 28.0 m -137.38 -1.8 2.07 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.122 1.369 . . . . 0.0 114.309 -174.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 164.1 177.1 36.57 Favored Glycine 0 CA--C 1.535 1.344 0 C-N-CA 124.275 0.94 . . . . 0.0 114.088 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 80.4 p -141.28 -0.17 1.45 Allowed 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -177.291 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 60.0 p -70.47 165.28 22.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.117 1.367 . . . . 0.0 113.282 175.045 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 166.18 -29.2 0.19 Allowed Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.153 0.883 . . . . 0.0 114.635 175.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 178.77 175.52 45.89 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 124.822 1.201 . . . . 0.0 113.405 176.302 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -72.34 -18.73 26.21 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.794 2.996 . . . . 0.0 113.67 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -149.37 133.61 17.34 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.863 1.665 . . . . 0.0 110.39 175.531 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 96.1 mt -145.37 172.1 13.67 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.729 2.011 . . . . 0.0 110.397 -176.27 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -142.57 151.44 57.41 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 124.227 1.011 . . . . 0.0 112.878 176.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -59.14 163.78 11.43 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.861 3.041 . . . . 0.0 114.402 169.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.46 24.51 3.46 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 126.54 1.936 . . . . 0.0 111.949 170.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -133.34 29.33 3.98 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 127.179 2.191 . . . . 0.0 112.699 -169.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -59.74 -22.23 61.79 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.69 1.196 . . . . 0.0 113.782 176.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 -82.53 7.54 14.2 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.545 1.938 . . . . 0.0 114.285 173.786 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 19.6 t -123.39 140.79 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 125.064 1.345 . . . . 0.0 111.509 -170.704 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 82.2 mt -115.43 164.69 13.92 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 127.573 2.349 . . . . 0.0 110.499 176.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -122.88 140.86 52.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.556 1.942 . . . . 0.0 108.246 168.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.5 t -133.47 138.16 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 124.772 1.229 . . . . 0.0 109.202 -170.445 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 12.1 m -128.19 137.91 52.25 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.142 1.377 . . . . 0.0 109.511 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -158.8 158.66 29.38 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.184 0.994 . . . . 0.0 112.38 -169.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -54.98 142.51 76.11 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.258 2.639 . . . . 0.0 111.89 168.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -57.0 -21.22 28.99 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.61 -20.66 66.4 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.013 1.325 . . . . 0.0 114.006 174.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -64.81 151.79 44.47 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.817 0.847 . . . . 0.0 112.194 173.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -133.26 171.9 13.41 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.902 1.681 . . . . 0.0 112.054 177.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.7 m -50.7 -35.03 29.13 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.475 1.51 . . . . 0.0 112.399 174.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.6 m -63.9 -44.76 92.04 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 174.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -65.48 -31.14 72.05 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.353 0.661 . . . . 0.0 111.391 175.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 83.6 mt -72.2 -45.87 58.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.804 0.842 . . . . 0.0 111.587 176.313 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.1 -36.17 74.69 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.101 -0.999 . . . . 0.0 112.616 170.189 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -68.28 -39.37 82.17 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.886 0.766 . . . . 0.0 112.842 174.2 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 48.4 tp -65.99 -40.82 91.51 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.713 1.205 . . . . 0.0 112.028 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -99.62 9.71 42.66 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.022 0.929 . . . . 0.0 113.471 -177.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 21.7 t -54.84 -31.48 59.52 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.459 1.504 . . . . 0.0 113.599 177.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.48 -14.0 6.87 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.585 1.554 . . . . 0.0 115.081 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -106.42 0.77 25.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.261 1.425 . . . . 0.0 113.767 -177.474 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.86 -47.19 3.26 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 126.097 1.808 . . . . 0.0 115.81 169.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -144.07 137.64 27.72 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.421 1.489 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 22.1 pt -146.5 174.92 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.386 1.474 . . . . 0.0 111.851 -172.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -143.8 148.04 35.0 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.942 1.297 . . . . 0.0 109.071 167.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 49.8 mt -130.9 136.28 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.257 1.023 . . . . 0.0 110.095 -173.205 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 37.5 m -135.13 102.75 5.3 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.745 1.618 . . . . 0.0 110.652 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -59.32 150.47 25.97 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.024 0.93 . . . . 0.0 113.486 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 36.8 pt -135.28 -21.07 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.632 1.173 . . . . 0.0 113.874 170.789 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -152.27 178.97 8.94 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.684 1.194 . . . . 0.0 112.013 175.541 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -68.27 -14.09 62.73 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.752 1.221 . . . . 0.0 113.234 173.175 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.2 p -132.94 3.52 3.75 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.637 1.575 . . . . 0.0 113.769 -172.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 97.1 p -154.26 155.91 36.07 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 174.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.47 159.51 42.32 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.025 1.73 . . . . 0.0 111.61 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -89.8 150.16 22.38 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.68 0.792 . . . . 0.0 110.28 167.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 60.4 t -137.82 121.36 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.921 1.288 . . . . 0.0 110.235 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 74.7 m -89.12 142.37 27.7 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.871 1.268 . . . . 0.0 110.929 173.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 82.3 mt -125.54 155.69 40.22 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.441 1.496 . . . . 0.0 110.511 175.202 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 67.0 m -68.84 -24.26 64.35 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -171.394 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -144.85 154.7 55.61 Favored Pre-proline 0 N--CA 1.474 0.732 0 C-N-CA 124.875 1.27 . . . . 0.0 112.503 -177.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.07 -21.47 27.43 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.109 2.539 . . . . 0.0 113.007 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.33 -40.66 97.06 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.223 -0.923 . . . . 0.0 111.376 169.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -66.42 -39.9 89.23 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.308 -0.87 . . . . 0.0 111.54 177.153 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 93.3 t -59.06 -47.76 88.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.449 1.1 . . . . 0.0 110.837 171.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -62.3 -39.5 93.22 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.516 0.726 . . . . 0.0 112.812 177.344 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.84 -46.16 97.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.757 0.823 . . . . 0.0 111.02 174.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.3 -38.58 89.93 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.117 0.872 . . . . 0.0 112.882 177.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.1 t -66.58 -37.25 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.187 0.995 . . . . 0.0 112.088 172.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -71.22 -31.0 67.04 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.23 -0.919 . . . . 0.0 113.281 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 23.9 p -91.58 -18.8 23.5 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -174.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 67.5 p -67.37 -21.61 65.61 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -61.78 -13.06 20.21 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -134.54 27.91 3.67 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.184 1.794 . . . . 0.0 112.729 174.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -54.95 150.24 10.48 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.26 1.424 . . . . 0.0 113.798 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -72.17 -37.6 69.3 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.566 1.146 . . . . 0.0 113.8 -174.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 32.8 t -164.46 -39.86 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.078 1.351 . . . . 0.0 112.149 -178.624 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -62.69 172.77 1.5 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.846 1.658 . . . . 0.0 112.72 169.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -142.9 149.24 38.21 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.212 1.805 . . . . 0.0 110.218 171.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 72.3 mt -133.52 140.8 45.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 125.726 1.61 . . . . 0.0 109.254 -179.011 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -145.31 166.16 26.34 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.388 1.875 . . . . 0.0 110.186 173.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 30.2 p -71.16 163.52 27.46 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.454 -1.404 . . . . 0.0 112.226 173.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -54.43 -41.14 69.04 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.534 -0.729 . . . . 0.0 112.117 169.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.23 -39.18 89.36 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.873 0.869 . . . . 0.0 113.264 177.229 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -65.13 -34.09 77.57 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.277 -0.889 . . . . 0.0 112.831 174.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -69.76 -47.48 62.83 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.393 0.677 . . . . 0.0 112.238 171.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 6.4 t -53.9 -40.19 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.732 1.213 . . . . 0.0 112.632 173.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -64.77 -19.86 65.69 Favored Glycine 0 CA--C 1.54 1.628 0 O-C-N 121.569 -0.707 . . . . 0.0 114.378 177.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -89.92 -19.55 24.42 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.205 1.402 . . . . 0.0 113.326 173.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -72.52 2.21 6.75 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.942 1.697 . . . . 0.0 114.295 169.796 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -52.17 -18.78 1.63 Allowed 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -55.88 -25.61 43.41 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.505 1.122 . . . . 0.0 113.67 170.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -77.85 -8.28 87.3 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 124.923 1.249 . . . . 0.0 115.293 176.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -63.41 -18.66 63.95 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.559 1.544 . . . . 0.0 114.553 -178.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -72.63 37.02 0.07 Allowed 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 126.491 1.916 . . . . 0.0 114.258 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 43.4 t -55.54 -24.54 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 126.457 1.903 . . . . 0.0 112.806 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 22.8 ptmt -57.68 -11.62 2.29 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 127.0 2.12 . . . . 0.0 116.166 172.486 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 14.7 t -142.49 156.25 45.14 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.164 1.386 . . . . 0.0 112.324 -176.62 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 164.66 -178.44 39.84 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 125.045 1.307 . . . . 0.0 113.551 -177.365 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -52.65 -17.23 6.66 Favored 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 125.288 3.992 . . . . 0.0 117.176 -178.18 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 78.3 p -126.33 7.21 7.06 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.068 1.747 . . . . 0.0 113.878 -178.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 79.3 p -143.51 -0.76 1.06 Allowed 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -175.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.643 1.592 . . . . 0.0 112.947 175.134 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.608 0 C5'-C4'-O4' 111.528 1.663 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? . . . . . 0 N--CA 1.483 1.2 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.44 -19.04 63.09 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.575 1.15 . . . . 0.0 113.906 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -96.98 12.35 32.77 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.143 2.177 . . . . 0.0 113.528 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 45.2 t -120.55 142.56 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.248 1.419 . . . . 0.0 110.995 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 96.3 mt -113.35 163.48 14.8 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 127.201 2.201 . . . . 0.0 111.352 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -123.0 138.71 54.62 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 127.043 2.137 . . . . 0.0 107.433 167.541 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 8.1 t -133.03 137.74 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.794 1.237 . . . . 0.0 109.017 -169.653 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 15.8 m -127.35 135.52 50.63 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.816 1.246 . . . . 0.0 109.754 -178.036 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -158.08 158.61 30.12 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.772 1.229 . . . . 0.0 112.303 -169.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.42 148.12 34.87 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.844 3.029 . . . . 0.0 113.17 168.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -58.87 -16.16 16.07 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.737 1.755 . . . . 0.0 115.737 -176.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -82.36 -14.71 54.84 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.31 1.444 . . . . 0.0 113.948 177.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -62.62 148.72 45.41 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.129 0.877 . . . . 0.0 112.134 173.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -129.69 165.91 20.9 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.962 1.705 . . . . 0.0 111.781 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 m -50.51 -36.06 32.29 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.765 1.226 . . . . 0.0 112.42 172.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.1 m -65.89 -41.54 91.39 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 175.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -64.82 -31.61 72.92 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.737 -0.602 . . . . 0.0 111.18 173.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.62 -46.29 54.83 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.103 0.961 . . . . 0.0 111.573 177.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -58.55 -38.33 77.59 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.23 -0.919 . . . . 0.0 112.48 169.95 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -67.2 -39.74 86.38 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.908 0.776 . . . . 0.0 112.879 175.48 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 41.7 tp -65.54 -44.16 87.72 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.792 1.237 . . . . 0.0 111.687 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -95.36 6.9 47.79 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -175.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 8.7 t -55.18 -26.67 40.52 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.181 1.393 . . . . 0.0 113.413 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -61.06 -10.56 6.29 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.689 1.595 . . . . 0.0 114.973 174.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -122.68 8.03 9.46 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.501 1.52 . . . . 0.0 113.543 -174.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 80.8 -145.8 26.38 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 121.239 -0.913 . . . . 0.0 113.213 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -63.31 144.03 57.3 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.076 0.95 . . . . 0.0 112.401 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.9 pt -144.95 175.72 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 126.335 1.854 . . . . 0.0 111.491 -175.017 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -136.16 150.35 49.01 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.47 1.508 . . . . 0.0 109.392 168.443 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 69.0 mt -133.58 133.49 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.208 1.403 . . . . 0.0 109.227 -171.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 42.7 m -136.13 100.51 4.43 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.658 1.583 . . . . 0.0 111.196 -177.437 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -59.8 151.06 26.42 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 32.1 pt -135.09 -20.12 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 124.837 1.255 . . . . 0.0 113.622 169.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -152.37 -179.12 7.27 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.66 1.184 . . . . 0.0 112.104 175.662 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.33 -25.66 68.14 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.888 1.275 . . . . 0.0 112.719 170.094 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.7 p -125.29 4.13 7.78 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.949 1.699 . . . . 0.0 114.026 -169.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 93.4 p -154.58 156.16 36.05 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 172.055 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.84 160.18 42.1 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.954 1.702 . . . . 0.0 111.459 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -90.86 150.99 21.32 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.525 0.73 . . . . 0.0 110.108 167.726 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 68.6 t -138.66 126.6 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 124.855 1.262 . . . . 0.0 109.896 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 9.4 t -95.28 137.38 34.41 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.504 1.122 . . . . 0.0 111.253 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 71.9 mt -122.54 158.75 29.2 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.066 1.747 . . . . 0.0 110.177 177.118 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 99.0 p -80.67 -9.85 59.77 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -171.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -145.74 151.09 45.27 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.109 1.364 . . . . 0.0 111.915 177.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -71.57 -19.52 28.09 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.209 2.606 . . . . 0.0 113.308 172.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -65.13 -40.3 94.25 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.683 -1.261 . . . . 0.0 111.677 170.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -64.93 -39.04 92.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.734 0.814 . . . . 0.0 111.401 175.378 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 23.1 t -56.84 -50.71 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.368 1.067 . . . . 0.0 111.173 170.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -60.48 -41.69 94.73 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.391 0.541 . . . . 0.0 112.311 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 81.1 mt -62.62 -47.11 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.862 0.865 . . . . 0.0 111.28 175.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.55 -40.71 97.68 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 119.232 0.923 . . . . 0.0 112.874 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 77.9 t -66.97 -34.01 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.184 0.994 . . . . 0.0 112.172 175.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -70.28 -46.43 64.37 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.114 -0.991 . . . . 0.0 112.221 173.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 24.0 p -73.81 -25.22 59.99 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -174.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 53.7 p -66.4 -19.71 65.87 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -57.39 -22.38 42.46 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.813 1.245 . . . . 0.0 113.746 174.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -98.5 -5.62 31.88 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.198 1.399 . . . . 0.0 113.42 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -77.17 145.5 37.64 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.482 1.113 . . . . 0.0 112.562 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -129.76 0.46 4.87 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.908 1.283 . . . . 0.0 114.286 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 46.6 m -126.61 0.86 6.84 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.809 1.644 . . . . 0.0 112.986 177.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -161.22 171.63 18.1 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.524 2.33 . . . . 0.0 109.741 175.71 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 18.3 tpp85 -148.64 155.13 40.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.855 1.262 . . . . 0.0 111.127 169.837 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 73.9 mt -134.66 141.59 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.052 1.741 . . . . 0.0 109.387 -173.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -145.96 168.68 20.28 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.259 1.824 . . . . 0.0 110.557 172.237 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 30.4 p -71.62 163.03 28.52 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 120.662 -1.274 . . . . 0.0 112.347 173.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -57.21 -40.8 78.18 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.263 -0.898 . . . . 0.0 111.733 169.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.73 85.12 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.763 0.825 . . . . 0.0 113.03 177.704 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.38 -42.31 96.21 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.235 -0.916 . . . . 0.0 112.212 171.456 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 90.4 t80 . . . . . 0 CA--C 1.542 0.635 0 CA-C-N 119.03 0.832 . . . . 0.0 111.989 174.873 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.9 mmt-85 . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -58.74 -19.54 41.23 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.161 1.384 . . . . 0.0 113.731 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -115.34 16.61 16.76 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.588 2.355 . . . . 0.0 112.904 -175.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 42.9 t -123.1 138.47 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.677 1.191 . . . . 0.0 112.165 -170.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 76.8 mt -118.22 164.3 15.38 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 127.191 2.196 . . . . 0.0 110.839 175.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -118.09 141.96 47.92 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.802 2.041 . . . . 0.0 107.908 167.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.7 t -133.16 139.25 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.556 1.542 . . . . 0.0 109.107 -171.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.5 m -128.14 134.87 49.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.346 1.458 . . . . 0.0 109.594 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -158.32 158.58 29.85 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.715 1.206 . . . . 0.0 111.539 -170.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -66.17 151.16 84.31 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.061 1.841 . . . . 0.0 111.065 169.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -60.65 -11.72 8.14 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -66.68 -19.81 65.84 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.47 1.108 . . . . 0.0 113.522 171.297 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -73.61 153.31 40.24 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.285 1.034 . . . . 0.0 112.758 175.866 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 173.46 11.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.6 1.96 . . . . 0.0 111.691 175.456 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 m -49.12 -35.77 17.25 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.197 1.399 . . . . 0.0 112.395 171.538 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.7 m -64.5 -43.31 94.51 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 176.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -65.92 -31.61 72.64 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.653 -0.654 . . . . 0.0 111.187 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.0 mt -71.44 -43.7 66.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.868 0.867 . . . . 0.0 111.502 175.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -58.68 -42.43 88.51 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.943 -1.098 . . . . 0.0 111.753 169.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -62.81 -33.82 76.02 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 119.035 0.834 . . . . 0.0 112.971 176.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.2 tp -73.37 -29.93 62.95 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.789 1.236 . . . . 0.0 113.369 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -121.06 -0.2 10.06 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -169.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 78.0 p -56.88 -23.91 48.03 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 176.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -57.71 -17.07 13.03 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.469 1.508 . . . . 0.0 114.545 174.378 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -99.56 3.71 45.54 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.218 1.407 . . . . 0.0 113.99 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.67 -44.1 3.04 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.955 1.741 . . . . 0.0 115.817 168.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -150.16 133.84 16.7 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.878 1.271 . . . . 0.0 110.594 177.481 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.9 pt -146.1 173.25 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.018 1.327 . . . . 0.0 112.101 -172.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 62.8 tp60 -139.92 139.1 36.1 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.002 1.321 . . . . 0.0 108.817 167.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 71.8 mt -112.94 132.36 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.11 1.364 . . . . 0.0 108.279 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 57.9 m -141.03 95.97 2.93 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.258 1.423 . . . . 0.0 111.095 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -57.97 152.68 15.81 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -177.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 37.7 pt -134.26 -19.8 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 125.21 1.404 . . . . 0.0 113.398 169.185 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -153.64 178.27 10.04 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.733 1.213 . . . . 0.0 111.994 174.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -63.61 -17.42 62.86 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.36 1.864 . . . . 0.0 112.733 171.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.2 p -135.07 7.59 3.42 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 127.197 2.199 . . . . 0.0 113.64 -171.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 4.0 m -149.66 146.37 27.23 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.21 1.004 . . . . 0.0 113.693 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.44 158.98 43.4 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.189 1.395 . . . . 0.0 112.04 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -90.38 152.75 20.86 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.75 0.82 . . . . 0.0 109.726 167.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.0 t -136.11 115.05 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 C-N-CA 124.231 1.012 . . . . 0.0 110.42 173.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 24.0 m -79.21 143.36 35.42 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.248 1.419 . . . . 0.0 109.831 169.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 76.7 mt -119.7 161.6 20.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.938 1.295 . . . . 0.0 111.092 175.838 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 21.1 t -60.32 -34.84 74.39 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.627 1.171 . . . . 0.0 113.673 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -140.32 151.53 64.55 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 125.179 1.392 . . . . 0.0 111.684 -177.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -69.21 -23.71 32.99 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.129 2.553 . . . . 0.0 113.868 -178.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.72 -33.64 75.53 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 120.863 -1.148 . . . . 0.0 112.387 173.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -66.1 -27.71 68.26 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.284 1.033 . . . . 0.0 112.785 -179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 90.0 t -61.93 -46.56 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.776 1.23 . . . . 0.0 110.617 173.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -63.53 -41.25 98.48 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.642 0.777 . . . . 0.0 111.699 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.32 -51.32 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.652 0.781 . . . . 0.0 110.528 175.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.89 90.88 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.8 t -62.77 -36.72 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 O-C-N 121.025 -1.047 . . . . 0.0 111.754 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -73.11 -30.57 63.74 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -91.48 -33.06 15.35 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -176.604 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 90.0 p -70.08 -17.75 63.24 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 50.7 pttt -59.93 -12.07 7.0 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.162 1.541 . . . . 0.0 115.162 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -101.01 1.31 39.44 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.898 1.679 . . . . 0.0 113.968 178.023 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -61.85 159.26 14.2 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.63 1.172 . . . . 0.0 113.958 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.82 -1.93 2.18 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.033 1.333 . . . . 0.0 114.57 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 78.2 p -140.81 1.48 1.69 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.446 1.498 . . . . 0.0 114.172 -176.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -156.75 175.43 14.07 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.038 2.135 . . . . 0.0 109.983 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 76.6 ttt-85 -145.85 150.89 36.98 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.351 1.46 . . . . 0.0 110.895 172.479 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 85.0 mt -131.88 144.93 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 126.18 1.792 . . . . 0.0 109.577 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -150.27 169.27 21.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.735 1.614 . . . . 0.0 110.747 169.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 59.9 p -71.06 162.63 29.1 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 120.815 -1.178 . . . . 0.0 112.229 174.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -58.13 -37.57 74.86 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 121.386 -0.821 . . . . 0.0 112.085 169.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.71 -38.39 89.05 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.76 0.824 . . . . 0.0 113.0 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -67.66 -39.18 84.56 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.117 -0.989 . . . . 0.0 112.545 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 26.2 t80 . . . . . 0 CA--C 1.544 0.733 0 C-N-CA 123.775 0.83 . . . . 0.0 111.737 172.654 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -63.53 -23.85 67.56 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.569 1.147 . . . . 0.0 113.442 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -93.71 17.57 11.65 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 127.502 2.321 . . . . 0.0 113.584 176.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 24.6 t -126.52 135.88 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.813 1.245 . . . . 0.0 111.399 -170.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 89.7 mt -103.11 167.0 10.11 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.693 1.997 . . . . 0.0 111.8 174.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -122.95 135.69 54.58 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 127.376 2.27 . . . . 0.0 107.224 167.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.4 t -131.35 140.16 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.797 1.239 . . . . 0.0 109.084 -171.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 9.9 m -131.18 136.62 48.45 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.041 1.336 . . . . 0.0 109.76 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -158.91 158.74 29.34 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.477 1.111 . . . . 0.0 112.415 -169.708 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -53.79 148.72 35.89 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.79 2.993 . . . . 0.0 113.281 169.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -61.11 -9.33 4.44 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -85.02 -12.23 53.62 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.333 1.453 . . . . 0.0 113.931 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 7.9 m95 -63.61 157.7 23.17 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -131.52 162.93 29.11 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.577 1.951 . . . . 0.0 111.651 -178.369 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.6 m -52.74 -35.95 56.96 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.763 1.225 . . . . 0.0 111.999 169.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.2 m -66.37 -41.52 89.34 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.496 0.925 . . . . 0.0 113.496 176.458 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -65.28 -30.68 71.57 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.792 -0.567 . . . . 0.0 111.393 173.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 62.0 mt -70.71 -47.31 60.45 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.867 0.867 . . . . 0.0 111.479 175.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -58.41 -38.93 78.4 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.99 -1.069 . . . . 0.0 112.452 170.441 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -65.91 -39.34 90.5 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.072 0.851 . . . . 0.0 112.844 175.438 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.38 -33.84 75.53 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.243 1.417 . . . . 0.0 112.11 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -110.85 9.8 22.47 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.711 1.374 . . . . 0.0 114.711 -174.385 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 32.8 m -57.97 -22.06 47.38 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 121.03 -1.044 . . . . 0.0 113.771 173.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.08 -15.23 12.8 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.435 1.494 . . . . 0.0 114.685 171.218 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -113.33 4.01 16.19 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.587 1.555 . . . . 0.0 113.627 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.68 -44.95 2.82 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 126.0 1.762 . . . . 0.0 115.242 172.536 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -153.3 144.38 22.97 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.826 1.25 . . . . 0.0 111.894 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 15.4 pt -145.35 176.03 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 126.349 1.86 . . . . 0.0 111.611 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -136.85 145.23 44.17 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.944 1.298 . . . . 0.0 109.415 168.102 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 76.2 mt -123.51 134.51 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.438 1.095 . . . . 0.0 110.051 -169.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.4 m -134.33 96.89 3.69 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 126.216 1.806 . . . . 0.0 109.966 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -55.83 155.8 5.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.475 1.11 . . . . 0.0 113.88 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 12.7 mt -128.49 -39.07 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.967 1.307 . . . . 0.0 109.959 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -153.67 -172.4 4.22 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.71 1.604 . . . . 0.0 110.52 174.27 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -63.93 -17.75 63.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.687 1.195 . . . . 0.0 113.073 172.254 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.9 p -127.41 2.87 6.28 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 126.433 1.893 . . . . 0.0 114.332 -169.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 80.1 p -153.73 153.92 33.11 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.94 151.73 31.6 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.45 1.5 . . . . 0.0 111.86 -179.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -89.59 145.87 24.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.936 0.894 . . . . 0.0 108.86 167.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.4 t -137.88 111.26 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.86 0.864 . . . . 0.0 110.984 -176.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 66.5 m -75.87 138.31 41.0 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.917 1.687 . . . . 0.0 110.955 171.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 49.5 mt -112.61 163.39 14.58 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.303 1.041 . . . . 0.0 112.199 178.757 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 17.6 t -64.37 -34.04 77.25 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.252 1.021 . . . . 0.0 113.318 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -141.11 149.49 55.69 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.333 1.453 . . . . 0.0 111.21 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.44 -24.65 26.32 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.95 2.433 . . . . 0.0 113.991 -177.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.52 -27.03 68.17 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.754 -1.216 . . . . 0.0 113.39 174.411 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -67.43 -26.14 66.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.434 1.094 . . . . 0.0 112.272 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.5 t -61.78 -45.38 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.936 1.294 . . . . 0.0 110.257 176.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.25 -39.63 92.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.79 0.836 . . . . 0.0 111.825 177.459 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 99.3 mt -60.96 -49.67 83.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 123.91 0.884 . . . . 0.0 110.573 175.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.15 93.42 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 74.8 t -63.66 -40.62 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.427 -0.795 . . . . 0.0 110.961 173.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -64.05 -45.13 90.17 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.889 0.768 . . . . 0.0 112.836 175.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -72.9 -27.5 61.92 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -176.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 31.7 p -62.77 -19.76 64.31 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -60.07 -12.6 8.64 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.245 1.418 . . . . 0.0 114.011 171.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -121.0 12.09 11.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.009 1.723 . . . . 0.0 112.699 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.72 164.37 10.0 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.661 1.185 . . . . 0.0 113.061 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -132.98 -13.37 2.81 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.141 1.376 . . . . 0.0 113.085 178.179 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 71.1 p -145.84 7.71 1.09 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.114 1.365 . . . . 0.0 114.682 -170.448 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -157.72 175.06 14.39 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.978 1.711 . . . . 0.0 111.418 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 -146.4 149.66 34.18 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.219 1.808 . . . . 0.0 110.507 172.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 88.0 mt -133.87 145.67 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.853 1.661 . . . . 0.0 109.605 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.2 pt20 -149.73 170.43 18.74 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.128 1.771 . . . . 0.0 110.36 169.615 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 25.4 p -72.08 164.51 26.03 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.536 -1.352 . . . . 0.0 112.191 173.028 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -55.34 -41.79 72.96 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.273 -0.892 . . . . 0.0 111.934 169.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -69.38 -38.13 77.89 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.859 0.864 . . . . 0.0 113.213 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -61.44 -41.31 97.0 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.841 0.856 . . . . 0.0 111.962 173.649 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 66.1 t80 . . . . . 0 CA--C 1.54 0.561 0 CA-C-N 118.383 0.538 . . . . 0.0 111.843 172.581 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 . . . . . 0 N--CA 1.48 1.043 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -60.34 -14.21 17.24 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.395 1.478 . . . . 0.0 114.524 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 46.3 p-80 -117.3 18.05 14.54 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 128.154 2.582 . . . . 0.0 112.44 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 26.6 t -123.92 143.75 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.239 1.416 . . . . 0.0 111.267 -174.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 70.8 mt -121.88 166.54 14.25 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.462 2.305 . . . . 0.0 110.672 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -125.21 142.82 51.27 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 126.641 1.977 . . . . 0.0 108.395 168.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -135.64 142.46 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.836 1.254 . . . . 0.0 109.558 -169.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 2.0 m -129.65 137.4 50.64 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.119 1.368 . . . . 0.0 109.796 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -159.36 157.3 27.01 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 124.413 1.085 . . . . 0.0 112.371 -169.155 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.52 143.85 65.65 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.721 2.947 . . . . 0.0 112.75 169.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -55.61 -25.38 38.38 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.073 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -65.95 -13.41 59.72 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.562 1.545 . . . . 0.0 114.356 177.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -69.14 156.37 38.8 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.321 1.048 . . . . 0.0 112.784 172.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -128.99 171.17 12.61 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.538 1.935 . . . . 0.0 110.969 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.0 m -52.41 -32.55 39.58 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.025 1.33 . . . . 0.0 111.757 169.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.3 m -64.46 -43.23 94.88 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 173.903 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -66.48 -30.99 71.44 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.572 -0.705 . . . . 0.0 111.277 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 74.9 mt -70.15 -43.77 70.19 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.639 0.776 . . . . 0.0 111.408 173.813 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -58.5 -39.91 81.35 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 120.854 -1.154 . . . . 0.0 112.196 169.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -65.83 -34.51 78.31 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 119.126 0.875 . . . . 0.0 113.038 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 58.3 tp -70.64 -31.03 67.83 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.595 1.158 . . . . 0.0 113.056 176.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -117.22 6.03 12.74 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -171.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 78.2 p -57.67 -25.29 60.02 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 178.004 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.16 -15.65 15.82 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.549 1.54 . . . . 0.0 114.662 176.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -101.8 3.07 39.04 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.108 1.363 . . . . 0.0 114.069 -176.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.89 -48.72 4.1 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.906 1.717 . . . . 0.0 114.998 169.48 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -152.13 140.18 20.2 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.805 1.242 . . . . 0.0 111.113 176.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 30.5 pt -146.0 174.94 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.925 1.69 . . . . 0.0 111.842 -171.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 8.0 tm0? -139.91 139.54 36.22 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.978 1.311 . . . . 0.0 108.612 169.153 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 72.5 mt -120.84 130.07 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.879 1.272 . . . . 0.0 109.448 -175.029 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.3 m -134.78 99.61 4.37 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.335 1.454 . . . . 0.0 111.335 -176.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -57.4 152.26 14.74 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.768 1.227 . . . . 0.0 113.666 175.802 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 19.6 pt -134.15 -25.86 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.77 1.228 . . . . 0.0 113.173 169.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -156.0 179.32 9.33 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.048 1.339 . . . . 0.0 112.114 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.88 -14.09 60.84 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 -175.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 50.1 p -132.46 6.44 4.11 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.295 1.438 . . . . 0.0 113.603 -177.253 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 1.1 p -150.92 152.15 33.2 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 173.17 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -155.34 159.45 39.95 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.372 1.469 . . . . 0.0 111.87 -174.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.87 152.48 21.23 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.426 0.69 . . . . 0.0 110.769 168.168 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 59.6 t -137.21 116.25 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.954 1.301 . . . . 0.0 109.748 174.645 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 8.4 t -85.08 140.85 30.67 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.961 1.304 . . . . 0.0 110.53 172.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 60.9 mt -117.77 165.05 14.1 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.235 1.414 . . . . 0.0 111.548 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 9.4 t -62.97 -32.38 73.7 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.399 1.08 . . . . 0.0 113.864 -173.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -152.67 157.34 33.44 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.193 0.997 . . . . 0.0 112.919 175.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.13 -33.24 63.1 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.393 3.395 . . . . 0.0 115.517 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -58.21 -35.65 71.96 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -70.0 -23.4 63.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.405 1.082 . . . . 0.0 113.262 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 99.0 t -59.48 -44.22 92.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.155 1.382 . . . . 0.0 111.094 177.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -66.57 -34.95 79.05 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.594 0.758 . . . . 0.0 112.061 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 59.8 mt -64.96 -48.15 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.696 0.798 . . . . 0.0 110.212 176.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.95 -38.51 91.34 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.3 t -63.97 -40.22 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 121.31 -0.869 . . . . 0.0 111.361 173.126 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -61.09 -49.92 75.34 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.03 0.832 . . . . 0.0 112.201 172.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.0 p -67.3 -27.01 66.82 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -174.693 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 9.4 t -64.27 -19.7 65.57 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 171.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -60.78 -18.82 57.42 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.519 1.128 . . . . 0.0 113.147 172.497 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -117.33 7.69 12.92 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.858 1.663 . . . . 0.0 112.762 -175.341 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.22 156.97 30.14 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.27 1.428 . . . . 0.0 113.392 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -134.23 -12.26 2.47 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.773 1.229 . . . . 0.0 114.058 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 38.3 m -139.13 6.89 2.4 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.08 1.352 . . . . 0.0 113.744 -173.915 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -158.65 176.01 12.92 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.042 1.737 . . . . 0.0 111.31 -176.68 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 498' ' ' ARG . . . . . 0.456 HH22 ' NE2' ' A' ' 500' ' ' GLN . 50.1 ttp85 -147.27 145.79 29.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.581 1.952 . . . . 0.0 110.098 174.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 69.5 mt -130.77 141.97 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.738 1.615 . . . . 0.0 109.629 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 500' ' ' GLN . . . . . 0.456 ' NE2' HH22 ' A' ' 498' ' ' ARG . 24.0 pt20 -145.1 166.59 24.96 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.825 1.65 . . . . 0.0 110.924 171.124 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 52.0 p -71.72 163.24 28.15 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 120.756 -1.215 . . . . 0.0 112.378 174.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -58.69 -37.01 75.13 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.187 -0.946 . . . . 0.0 112.063 170.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.71 95.95 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.333 -0.854 . . . . 0.0 112.809 174.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -65.35 -32.68 74.45 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.348 -0.845 . . . . 0.0 112.977 173.375 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 73.2 t80 . . . . . 0 CA--C 1.539 0.532 0 CA-C-N 119.119 0.872 . . . . 0.0 111.427 169.586 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 113.874 1.065 . . . . 0.0 113.874 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.64 -15.42 63.64 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.649 -1.282 . . . . 0.0 113.578 176.327 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 -88.19 8.0 29.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.401 1.881 . . . . 0.0 114.08 172.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 40.7 t -110.86 148.58 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.092 1.357 . . . . 0.0 110.903 -173.757 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 94.5 mt -122.69 164.24 18.63 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.186 2.594 . . . . 0.0 110.522 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -126.75 139.12 53.37 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.461 1.905 . . . . 0.0 107.679 168.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.4 t -132.85 141.83 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.975 1.31 . . . . 0.0 109.226 -169.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.6 m -132.88 135.15 45.42 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.881 1.272 . . . . 0.0 109.753 -177.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -159.85 162.55 24.51 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 124.994 1.318 . . . . 0.0 111.719 -168.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.44 149.14 90.55 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.215 1.943 . . . . 0.0 110.909 168.733 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -18.54 13.71 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -57.34 -26.26 60.69 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.052 1.741 . . . . 0.0 113.979 173.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 19.7 m95 -64.65 154.4 36.56 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.001 0.921 . . . . 0.0 113.087 175.315 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -132.17 164.99 25.1 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.597 1.959 . . . . 0.0 111.129 177.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.9 m -53.29 -34.75 58.61 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.743 1.217 . . . . 0.0 112.156 173.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.2 m -65.36 -43.35 91.11 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.734 1.012 . . . . 0.0 113.734 175.137 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -64.81 -31.64 72.96 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.675 -0.64 . . . . 0.0 111.309 174.35 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.2 mt -71.05 -44.99 64.66 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.031 0.932 . . . . 0.0 111.551 175.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -57.22 -42.54 81.57 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.009 -1.057 . . . . 0.0 112.109 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -68.26 -29.07 67.79 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.458 1.103 . . . . 0.0 113.935 177.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.6 tp -69.5 -36.49 76.52 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.334 1.054 . . . . 0.0 112.316 173.547 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -110.96 -2.61 15.92 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -170.515 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 79.0 p -58.09 -19.66 33.8 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 176.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -57.41 -18.93 20.36 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.084 1.354 . . . . 0.0 114.133 170.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -100.18 2.71 43.2 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.743 1.617 . . . . 0.0 113.612 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 96.27 -159.67 21.97 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.011 1.291 . . . . 0.0 111.891 -171.742 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -64.24 150.37 46.06 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 121.838 -0.801 . . . . 0.0 111.25 169.203 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 5.5 pt -143.53 179.76 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 125.338 1.455 . . . . 0.0 111.655 -174.668 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -128.15 151.9 48.66 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.537 1.535 . . . . 0.0 110.699 170.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 60.3 mt -139.4 134.35 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.919 1.688 . . . . 0.0 108.972 -172.584 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.9 m -139.35 102.2 4.43 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.991 1.316 . . . . 0.0 111.384 -177.45 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -59.28 153.15 19.28 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 29.5 pt -134.9 -23.93 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.831 1.252 . . . . 0.0 113.416 169.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -153.7 174.38 14.59 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.353 1.061 . . . . 0.0 111.947 174.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -60.88 -15.09 26.82 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.601 1.96 . . . . 0.0 113.898 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 37.2 p -135.91 6.24 3.14 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.001 2.12 . . . . 0.0 113.448 -174.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 66.5 m -147.38 140.29 25.0 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.394 1.078 . . . . 0.0 113.218 -174.281 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.45 158.7 42.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.529 1.131 . . . . 0.0 112.49 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -89.04 153.29 21.12 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.753 0.821 . . . . 0.0 110.006 167.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 73.4 t -136.3 140.53 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.92 1.288 . . . . 0.0 109.091 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 43.0 m -124.97 116.09 21.61 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.206 1.403 . . . . 0.0 110.083 -169.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 47.1 mt -102.94 166.32 10.52 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.202 1.401 . . . . 0.0 111.176 -175.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 50.8 m -69.84 -26.75 64.37 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 -175.279 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -148.22 148.85 30.54 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 124.497 1.119 . . . . 0.0 112.348 -177.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -57.18 -26.02 67.37 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 123.5 2.8 . . . . 0.0 114.124 168.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -61.04 -33.54 73.46 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.064 -1.023 . . . . 0.0 112.56 172.25 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -76.46 -34.31 58.7 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.845 0.858 . . . . 0.0 111.799 174.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 22.4 t -57.54 -44.69 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.065 0.946 . . . . 0.0 111.354 170.292 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -58.97 -41.04 86.58 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.133 0.573 . . . . 0.0 112.378 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 91.0 mt -66.87 -45.76 86.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.634 0.773 . . . . 0.0 110.938 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.1 -34.32 76.1 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 119.324 0.965 . . . . 0.0 113.466 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 60.4 t -65.73 -43.84 93.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 O-C-N 121.296 -0.878 . . . . 0.0 111.003 170.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -60.5 -45.06 95.16 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.922 0.783 . . . . 0.0 112.729 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 46.0 p -71.64 -27.4 63.06 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -177.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 24.8 p -63.21 -19.05 64.17 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 59.1 mtmt -60.96 -18.38 56.95 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.254 1.422 . . . . 0.0 113.963 173.452 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -119.06 1.4 11.41 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.064 1.345 . . . . 0.0 113.211 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -68.19 152.78 44.96 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.669 1.188 . . . . 0.0 112.469 173.922 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -132.27 -4.9 3.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.818 1.247 . . . . 0.0 114.044 -177.564 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 22.6 m -136.52 5.9 2.96 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.322 1.449 . . . . 0.0 113.413 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -161.04 171.52 18.47 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.039 2.135 . . . . 0.0 110.173 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -147.79 156.88 43.2 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.122 1.369 . . . . 0.0 111.06 169.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 69.3 mt -133.49 146.38 32.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.766 1.626 . . . . 0.0 109.572 -174.375 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -142.11 161.78 37.15 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.98 1.712 . . . . 0.0 109.679 168.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 26.3 p -71.89 162.29 29.67 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.702 -1.249 . . . . 0.0 111.888 173.687 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -60.39 -33.41 72.44 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.161 -0.962 . . . . 0.0 111.953 169.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.91 -38.02 89.58 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.299 -0.875 . . . . 0.0 113.111 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -67.78 -39.67 84.07 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.09 -1.006 . . . . 0.0 112.144 172.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 62.0 t80 . . . . . 0 CA--C 1.545 0.777 0 C-N-CA 124.247 1.019 . . . . 0.0 112.288 174.175 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.924 0 CA-C-O 121.563 0.697 . . . . 0.0 112.398 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -156.13 -43.07 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.816 2.046 . . . . 0.0 109.729 170.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 -70.26 38.19 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.132 2.973 . . . . 0.0 112.941 168.396 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 46.3 t -128.07 126.11 65.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 125.005 1.322 . . . . 0.0 111.027 -168.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 83.8 mt -92.68 168.31 11.31 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.423 1.889 . . . . 0.0 111.723 174.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 41.2 t-80 -128.19 136.23 50.81 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.43 2.292 . . . . 0.0 106.928 166.478 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 10.7 t -132.77 136.02 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.602 1.161 . . . . 0.0 109.091 -171.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 16.5 m -124.82 135.51 53.0 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.109 1.364 . . . . 0.0 109.689 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -156.2 156.51 30.39 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 124.487 1.115 . . . . 0.0 112.671 -169.165 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.22 150.96 30.54 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.813 3.009 . . . . 0.0 112.644 168.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -56.18 -22.19 27.49 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -62.09 -27.66 69.07 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.456 1.503 . . . . 0.0 113.512 176.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -68.54 150.2 48.32 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.118 0.967 . . . . 0.0 112.968 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 36.0 mttm -135.08 174.29 10.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.366 1.866 . . . . 0.0 112.145 176.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.4 m -48.36 -36.35 14.35 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.026 1.73 . . . . 0.0 112.713 173.869 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.8 m -64.63 -45.33 87.27 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 175.603 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -63.49 -30.93 71.98 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.369 0.668 . . . . 0.0 111.416 175.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 73.6 mt -71.02 -46.62 61.82 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.821 0.849 . . . . 0.0 111.639 175.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -61.95 -31.11 71.42 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.639 -1.288 . . . . 0.0 113.422 171.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -72.65 -34.65 67.41 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.442 1.097 . . . . 0.0 113.26 172.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 65.2 tp -64.5 -30.61 71.64 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.469 1.108 . . . . 0.0 112.253 172.394 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -115.64 22.95 12.72 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.95 1.3 . . . . 0.0 113.938 -175.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 92.1 p -59.12 -21.61 59.57 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.309 1.043 . . . . 0.0 113.796 172.897 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -61.73 -19.2 62.16 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.505 1.522 . . . . 0.0 114.047 169.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -115.05 -39.39 3.66 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.389 1.475 . . . . 0.0 111.483 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 65.36 7.98 35.49 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 125.707 1.622 . . . . 0.0 117.06 169.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -143.06 17.61 1.93 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.194 1.398 . . . . 0.0 112.886 -170.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 19.5 pt -64.83 171.37 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 125.636 1.574 . . . . 0.0 113.577 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -134.55 144.05 47.75 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.301 1.441 . . . . 0.0 109.16 169.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 86.4 mt -121.63 133.97 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.154 0.982 . . . . 0.0 109.943 -169.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 71.2 m -134.82 97.03 3.66 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.138 1.775 . . . . 0.0 109.938 -176.771 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -57.86 158.32 6.61 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 8.9 mt -132.89 -42.93 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.974 1.309 . . . . 0.0 109.537 177.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -155.16 -179.03 7.68 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.461 1.504 . . . . 0.0 111.85 173.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -59.61 -16.16 23.81 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.805 1.642 . . . . 0.0 114.831 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 67.6 p -132.23 3.0 3.95 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.052 1.741 . . . . 0.0 114.577 -173.754 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 3.6 p -151.8 153.99 35.34 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 170.823 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -150.83 155.03 38.37 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.924 1.29 . . . . 0.0 112.353 -177.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -89.5 148.11 23.6 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.045 0.938 . . . . 0.0 109.517 167.908 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 56.4 t -138.61 111.24 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.956 0.902 . . . . 0.0 110.652 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 74.0 m -77.42 139.43 39.68 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.333 1.453 . . . . 0.0 111.44 174.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 52.1 mt -110.82 170.8 7.86 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.424 1.49 . . . . 0.0 111.625 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 61.9 m -77.97 -26.04 48.48 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -144.93 148.74 40.04 Favored Pre-proline 0 CA--C 1.544 0.734 0 C-N-CA 125.144 1.378 . . . . 0.0 111.207 178.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -55.1 -29.56 66.29 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.682 2.921 . . . . 0.0 114.551 171.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -59.89 -36.16 76.37 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.524 1.13 . . . . 0.0 113.1 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -67.28 -20.9 65.71 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.458 1.103 . . . . 0.0 113.252 -178.062 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 96.9 t -60.42 -44.43 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.241 1.016 . . . . 0.0 111.01 176.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -68.03 -35.42 78.24 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.721 0.808 . . . . 0.0 111.497 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 68.2 mt -61.79 -48.29 89.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.813 0.845 . . . . 0.0 110.453 176.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.8 82.31 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 72.0 t -65.9 -41.43 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 O-C-N 121.134 -0.979 . . . . 0.0 111.209 171.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -62.43 -32.31 73.14 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.148 0.979 . . . . 0.0 113.271 176.499 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 39.4 p -86.24 -27.52 24.4 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.019 0.928 . . . . 0.0 113.086 178.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 11.2 t -69.58 -24.05 63.63 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -60.67 -19.31 58.11 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -90.16 -10.34 44.89 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.305 1.442 . . . . 0.0 114.066 176.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -68.92 152.53 45.16 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.204 1.002 . . . . 0.0 113.535 -173.508 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -140.61 2.93 1.85 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.222 1.409 . . . . 0.0 113.864 175.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 77.4 p -135.84 1.07 2.74 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.271 1.828 . . . . 0.0 113.742 -177.154 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -156.34 175.04 14.53 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.425 2.29 . . . . 0.0 109.591 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 46.3 ttm180 -147.04 146.84 30.15 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.031 1.332 . . . . 0.0 110.984 175.444 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 48.3 mt -129.27 139.48 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.972 1.709 . . . . 0.0 109.055 175.347 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -147.57 171.27 15.84 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.449 1.9 . . . . 0.0 109.829 173.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 19.0 p -72.86 164.01 27.26 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 120.334 -1.479 . . . . 0.0 112.319 172.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -52.85 -44.6 66.88 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.523 0.729 . . . . 0.0 111.518 168.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -69.14 -35.25 76.17 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -63.58 -43.72 96.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.168 0.895 . . . . 0.0 111.965 173.471 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 75.9 t80 . . . . . 0 CA--C 1.537 0.471 0 C-N-CA 123.005 0.522 . . . . 0.0 111.773 174.208 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -60.37 -25.96 66.27 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 120.801 -1.187 . . . . 0.0 113.791 178.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -92.82 18.94 8.17 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.484 1.914 . . . . 0.0 113.737 176.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 24.6 t -125.85 147.44 30.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.773 1.229 . . . . 0.0 111.98 -169.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 74.3 mt -118.45 164.08 15.79 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.568 2.347 . . . . 0.0 110.849 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -122.87 139.2 54.28 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 126.783 2.033 . . . . 0.0 107.772 168.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.0 t -131.34 142.11 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.855 1.262 . . . . 0.0 109.345 -169.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.54 136.16 50.38 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.458 1.503 . . . . 0.0 109.581 -178.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -160.08 157.88 25.69 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 123.598 0.759 . . . . 0.0 112.963 -170.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.65 145.75 68.86 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.757 2.971 . . . . 0.0 112.499 168.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -55.69 -24.59 35.27 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 -176.329 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -67.1 -17.63 64.96 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.985 1.314 . . . . 0.0 114.162 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -62.63 155.08 27.16 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.094 0.958 . . . . 0.0 112.979 173.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -139.53 165.79 26.29 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.528 1.931 . . . . 0.0 110.674 -173.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.7 m -57.03 -32.48 66.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.115 0.966 . . . . 0.0 111.763 176.046 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 43.6 m -66.58 -42.03 87.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 173.331 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -65.79 -31.71 72.83 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.438 -0.789 . . . . 0.0 111.248 174.169 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.4 mt -70.68 -44.92 66.0 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.861 0.864 . . . . 0.0 111.501 174.262 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -57.51 -38.2 74.26 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.091 -1.006 . . . . 0.0 112.407 169.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -68.29 -40.36 81.8 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.98 0.809 . . . . 0.0 112.999 175.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.0 tp -64.32 -36.02 82.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.842 1.257 . . . . 0.0 112.273 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -106.84 10.42 30.68 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.569 1.148 . . . . 0.0 113.419 -176.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 22.2 t -55.81 -31.74 62.93 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.664 1.586 . . . . 0.0 113.791 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.84 -15.23 11.5 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.443 1.497 . . . . 0.0 115.021 178.068 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -101.63 -0.52 34.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.888 1.275 . . . . 0.0 114.11 -176.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 77.31 -41.73 1.85 Allowed Glycine 0 CA--C 1.536 1.399 0 C-N-CA 126.086 1.803 . . . . 0.0 116.101 169.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -148.59 130.81 15.5 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.282 1.433 . . . . 0.0 110.673 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 18.7 pt -145.92 174.73 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.435 1.494 . . . . 0.0 111.478 -172.351 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.88 146.82 41.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.813 1.245 . . . . 0.0 109.001 168.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 67.9 mt -127.78 130.07 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.032 1.333 . . . . 0.0 109.222 -174.019 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 51.8 m -136.85 94.74 3.01 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.195 1.398 . . . . 0.0 111.022 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -55.83 154.33 7.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.701 1.2 . . . . 0.0 113.633 176.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 17.7 pt -132.27 -28.97 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.474 1.109 . . . . 0.0 113.617 170.61 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -160.15 -175.16 4.91 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.917 1.287 . . . . 0.0 112.44 172.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -57.89 -22.0 46.17 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 -177.197 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.6 p -134.2 5.33 3.53 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.938 1.295 . . . . 0.0 113.979 -171.123 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 60.9 m -143.56 147.92 35.16 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.705 1.202 . . . . 0.0 113.295 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.26 156.23 39.29 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.299 1.44 . . . . 0.0 111.753 175.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -89.9 151.57 21.67 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.557 0.743 . . . . 0.0 110.18 168.115 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.5 t -137.98 115.9 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.496 1.118 . . . . 0.0 110.325 176.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 16.3 m -83.62 140.64 32.08 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.074 1.35 . . . . 0.0 110.673 172.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 80.4 mt -123.18 147.04 47.28 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.769 1.227 . . . . 0.0 110.2 176.24 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 5.2 m -65.8 -16.01 63.41 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 115.767 1.766 . . . . 0.0 115.767 -172.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -140.25 148.09 52.75 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 124.562 1.145 . . . . 0.0 111.429 175.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -70.0 -20.75 33.29 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.105 2.537 . . . . 0.0 113.579 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -66.59 -32.61 74.06 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.825 -1.172 . . . . 0.0 112.346 172.979 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -67.29 -31.2 71.35 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.163 0.985 . . . . 0.0 112.189 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.2 t -58.64 -46.42 90.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.242 1.417 . . . . 0.0 110.741 173.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -63.86 -41.92 97.66 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.501 0.72 . . . . 0.0 112.031 176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 94.6 mt -63.1 -42.55 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.579 0.752 . . . . 0.0 111.292 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.41 -39.72 95.26 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.114 -0.991 . . . . 0.0 113.094 176.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 69.2 t -66.16 -42.02 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 O-C-N 121.218 -0.926 . . . . 0.0 111.347 172.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -61.22 -37.66 83.84 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.121 0.968 . . . . 0.0 113.116 176.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 22.0 p -83.32 -28.87 28.74 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.556 1.142 . . . . 0.0 113.237 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 8.7 t -60.78 -19.38 59.23 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 171.235 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -51.77 -26.54 9.84 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.703 1.601 . . . . 0.0 113.661 169.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -114.9 10.15 16.31 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.606 1.562 . . . . 0.0 113.093 -174.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -64.71 156.56 29.97 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.931 1.293 . . . . 0.0 113.095 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.55 -5.46 1.21 Allowed 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 176.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 51.0 m -137.31 5.08 2.71 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.392 1.477 . . . . 0.0 113.629 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 49.5 p90 -157.92 176.07 13.02 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.241 1.816 . . . . 0.0 111.208 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 69.5 ttt-85 -147.34 145.21 29.24 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.003 2.121 . . . . 0.0 109.997 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 79.2 mt -132.5 141.61 44.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.434 1.494 . . . . 0.0 109.841 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -143.12 163.82 31.81 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.109 1.764 . . . . 0.0 110.509 169.594 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 65.1 p -73.02 161.51 30.59 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.753 -1.217 . . . . 0.0 112.347 174.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -60.42 -34.15 73.54 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.206 -0.934 . . . . 0.0 111.591 168.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -63.88 -37.82 88.81 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.447 -0.783 . . . . 0.0 113.09 174.308 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -66.52 -42.36 87.41 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.13 -0.982 . . . . 0.0 112.168 170.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 57.1 t80 . . . . . 0 CA--C 1.541 0.622 0 CA-C-N 118.777 0.717 . . . . 0.0 111.422 173.648 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 . . . . . 0 N--CA 1.485 1.308 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -63.35 -22.8 67.1 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 121.087 -1.008 . . . . 0.0 113.543 176.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -90.32 15.36 10.66 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.757 2.023 . . . . 0.0 113.93 175.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 42.5 t -117.59 141.78 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.929 1.292 . . . . 0.0 111.182 -173.85 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 93.7 mt -108.16 163.58 13.05 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 126.819 2.048 . . . . 0.0 111.489 176.234 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -122.53 136.19 54.83 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.699 2.0 . . . . 0.0 107.026 166.876 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 4.8 t -132.27 138.59 52.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 124.893 1.277 . . . . 0.0 109.088 -169.383 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.2 m -129.55 136.17 49.49 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.924 1.29 . . . . 0.0 109.529 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -158.85 155.96 25.8 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.404 1.082 . . . . 0.0 112.538 -169.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.13 144.85 78.86 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.5 2.8 . . . . 0.0 111.418 167.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 7.2 ptpt -59.59 -19.14 46.72 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -176.774 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.43 -21.77 66.49 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.696 1.598 . . . . 0.0 114.016 172.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -63.36 150.94 42.21 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.002 0.819 . . . . 0.0 112.276 172.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -130.73 169.1 16.14 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.329 1.852 . . . . 0.0 111.634 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.5 m -50.92 -34.46 28.63 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.652 1.181 . . . . 0.0 112.513 171.609 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 43.2 m -66.19 -40.18 90.24 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -66.82 -31.97 72.93 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.608 -0.683 . . . . 0.0 111.168 173.427 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 90.8 mt -70.56 -41.38 72.52 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.615 0.766 . . . . 0.0 111.485 174.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -60.55 -42.22 96.12 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.959 -1.088 . . . . 0.0 111.634 169.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.3 tt0 -60.78 -33.91 73.68 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.122 -0.986 . . . . 0.0 112.681 175.114 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 44.9 tp -79.49 -27.23 41.48 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.849 1.26 . . . . 0.0 114.105 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -128.76 -17.5 4.02 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 116.888 2.181 . . . . 0.0 116.888 -168.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 14.8 t -60.87 -21.8 63.63 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.63 1.559 . . . . 0.0 113.43 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -54.36 -24.32 19.01 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.413 1.485 . . . . 0.0 114.521 171.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -80.46 -1.23 40.75 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 99.77 -44.67 1.61 Allowed Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.705 1.622 . . . . 0.0 114.541 168.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -152.69 136.91 16.54 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.12 1.368 . . . . 0.0 110.391 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 29.1 pt -144.42 171.79 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.679 1.191 . . . . 0.0 112.298 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -143.89 145.82 32.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.133 1.373 . . . . 0.0 109.146 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 77.0 mt -127.15 128.71 70.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.752 1.221 . . . . 0.0 109.158 -172.462 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 46.3 m -136.18 99.38 4.11 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.455 1.502 . . . . 0.0 111.071 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -58.42 151.1 20.74 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.196 0.998 . . . . 0.0 113.63 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 38.2 pt -133.59 -19.84 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.778 1.231 . . . . 0.0 113.278 169.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -152.0 178.19 9.69 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.743 1.217 . . . . 0.0 111.713 172.826 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -66.17 -14.66 62.21 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.158 1.783 . . . . 0.0 112.926 174.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.0 p -134.64 5.03 3.39 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.598 1.959 . . . . 0.0 113.718 -172.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 88.0 p -155.05 154.9 33.16 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.39 161.5 42.25 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.663 1.585 . . . . 0.0 112.088 -177.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -93.48 149.66 21.06 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.982 0.913 . . . . 0.0 110.054 167.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.2 t -138.3 114.91 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.174 0.99 . . . . 0.0 110.746 177.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 19.3 m -77.61 141.21 39.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.835 1.254 . . . . 0.0 111.066 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 70.7 mt -121.08 165.62 15.07 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.42 1.488 . . . . 0.0 110.621 171.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 55.0 m -63.67 -29.66 70.86 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -146.47 152.4 45.71 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.628 1.171 . . . . 0.0 112.385 -176.703 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.37 -17.23 39.45 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.329 2.686 . . . . 0.0 113.497 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -63.23 -35.61 80.9 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.616 -1.303 . . . . 0.0 111.539 169.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -74.96 -30.57 61.25 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.125 0.97 . . . . 0.0 112.356 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 13.5 t -57.02 -44.96 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.008 0.923 . . . . 0.0 111.173 171.014 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -60.81 -41.27 95.34 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.107 0.563 . . . . 0.0 112.272 176.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 98.8 mt -61.43 -50.64 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.806 0.842 . . . . 0.0 110.668 176.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.87 -36.54 83.64 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 78.3 t -65.75 -41.16 89.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 121.117 -0.989 . . . . 0.0 111.242 171.985 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -63.2 -43.84 97.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.795 0.725 . . . . 0.0 112.832 176.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 35.3 p -68.86 -27.82 66.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.708 0.803 . . . . 0.0 113.068 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.3 t -65.53 -18.24 65.18 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 174.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -60.29 -14.32 17.52 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.702 1.201 . . . . 0.0 114.043 176.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -128.95 13.29 6.27 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.076 1.75 . . . . 0.0 112.609 -176.048 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.05 159.21 23.69 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.997 1.319 . . . . 0.0 113.044 175.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -138.06 -0.99 2.01 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -178.447 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 8.7 t -145.03 4.74 1.1 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.218 1.407 . . . . 0.0 113.006 -178.757 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -159.27 174.85 14.16 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.378 1.471 . . . . 0.0 111.637 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 79.2 ttt-85 -145.01 147.82 33.05 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.386 1.874 . . . . 0.0 110.313 169.553 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 68.4 mt -129.1 141.45 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.336 1.855 . . . . 0.0 109.611 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -144.52 166.07 26.2 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.932 1.693 . . . . 0.0 109.728 169.031 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 25.7 p -71.79 162.28 29.68 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.696 -1.252 . . . . 0.0 111.677 175.15 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -57.09 -39.19 74.52 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.278 -0.889 . . . . 0.0 111.829 168.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.76 -36.97 86.02 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -67.33 -40.96 85.95 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.171 -0.956 . . . . 0.0 112.145 173.368 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 71.3 t80 . . . . . 0 CA--C 1.54 0.584 0 CA-C-N 118.42 0.555 . . . . 0.0 111.476 172.605 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 73.4 mtt180 . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 116.077 1.881 . . . . 0.0 116.077 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.29 -15.57 57.64 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 -96.27 13.79 26.36 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.909 2.084 . . . . 0.0 113.695 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 55.4 t -128.0 143.5 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.915 1.286 . . . . 0.0 111.777 -171.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 72.1 mt -107.16 166.3 10.73 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 127.342 2.257 . . . . 0.0 111.496 175.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 22.8 t-80 -121.53 137.55 54.68 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.974 2.11 . . . . 0.0 107.103 166.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 13.4 t -133.81 139.72 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.877 1.271 . . . . 0.0 108.958 -169.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.0 m -128.72 132.52 47.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.193 1.397 . . . . 0.0 109.252 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -151.49 159.71 32.93 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.444 1.098 . . . . 0.0 112.895 -168.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -52.15 150.15 19.96 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.19 3.26 . . . . 0.0 114.058 170.682 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.0 pttm -53.67 -28.05 31.1 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.456 1.503 . . . . 0.0 115.048 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -81.55 -12.91 58.63 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.406 1.483 . . . . 0.0 114.212 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 7.6 m0 -65.63 152.8 43.31 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.305 0.957 . . . . 0.0 112.982 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -129.72 168.93 15.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.403 1.881 . . . . 0.0 111.832 -178.861 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.2 m -48.53 -35.45 13.29 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.444 1.498 . . . . 0.0 112.213 169.35 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 70.8 m -64.41 -43.72 93.5 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -64.54 -33.18 75.32 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.751 -0.593 . . . . 0.0 111.147 174.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.92 -44.57 65.91 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.87 0.868 . . . . 0.0 111.792 176.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.38 -43.42 92.91 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.166 -0.959 . . . . 0.0 112.018 169.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -61.43 -32.21 72.17 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.923 0.783 . . . . 0.0 112.977 175.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 52.7 tp -74.83 -34.3 62.31 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.499 1.12 . . . . 0.0 113.254 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -116.53 -5.88 11.69 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -169.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 87.1 p -57.62 -22.88 48.0 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 114.549 1.315 . . . . 0.0 114.549 175.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.4 -21.62 51.21 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.063 1.345 . . . . 0.0 114.17 173.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -94.24 -5.89 45.86 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.157 1.383 . . . . 0.0 113.779 177.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 109.69 -154.07 16.68 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 125.071 1.319 . . . . 0.0 112.213 -173.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -61.37 153.61 26.34 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.652 0.781 . . . . 0.0 112.13 169.46 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 33.0 pt -142.54 176.92 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 125.389 1.476 . . . . 0.0 111.795 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -143.82 146.16 32.87 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.2 1.4 . . . . 0.0 108.926 169.03 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 77.8 mt -129.48 133.28 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.679 1.192 . . . . 0.0 109.289 -172.402 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 39.5 m -134.78 97.38 3.76 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.742 1.617 . . . . 0.0 110.497 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -60.01 153.29 21.79 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.731 1.212 . . . . 0.0 113.955 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 28.9 pt -133.44 -24.47 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.817 1.247 . . . . 0.0 112.9 169.501 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -149.75 173.18 14.0 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.748 1.619 . . . . 0.0 112.064 173.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.81 -20.48 50.6 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.557 1.543 . . . . 0.0 113.66 169.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.4 p -126.58 0.93 6.86 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.046 1.738 . . . . 0.0 114.197 -172.09 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 36.3 p -154.4 151.26 28.8 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 174.28 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.87 160.58 43.08 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.617 1.567 . . . . 0.0 111.96 -176.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -89.13 149.76 23.02 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.448 0.699 . . . . 0.0 110.341 167.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 48.5 t -138.53 119.15 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 124.564 1.146 . . . . 0.0 110.773 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 14.1 t -80.99 144.52 31.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.191 1.396 . . . . 0.0 111.881 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 86.0 mt -129.66 155.6 45.61 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.737 1.615 . . . . 0.0 110.871 174.364 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 48.9 m -68.85 -24.17 64.33 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -169.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -137.99 151.45 70.12 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.75 1.22 . . . . 0.0 111.527 172.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -67.97 -18.63 46.42 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.262 2.641 . . . . 0.0 113.744 174.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.17 -37.93 89.24 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.662 -1.274 . . . . 0.0 111.98 170.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.3 -32.94 74.26 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.405 -0.81 . . . . 0.0 112.092 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.8 t -58.93 -47.28 90.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.79 1.236 . . . . 0.0 110.506 172.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -62.48 -42.87 99.79 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.571 -0.706 . . . . 0.0 112.211 176.252 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 87.4 mt -62.76 -43.81 99.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 123.76 0.824 . . . . 0.0 111.368 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.1 -38.56 91.68 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.324 -0.86 . . . . 0.0 113.069 177.157 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 71.1 t -66.76 -42.47 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 121.283 -0.886 . . . . 0.0 111.364 173.002 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -60.79 -44.44 96.8 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.032 0.833 . . . . 0.0 112.661 176.05 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 26.1 p -74.69 -21.74 59.23 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.224 1.009 . . . . 0.0 113.649 -178.008 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 21.2 p -65.2 -15.17 62.17 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 175.129 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -56.41 -15.14 3.64 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.671 1.588 . . . . 0.0 114.122 172.285 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -126.93 16.04 7.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.286 1.834 . . . . 0.0 112.333 -174.528 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.51 -36.75 84.77 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -174.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 52.68 -18.65 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 129.751 3.22 . . . . 0.0 118.906 -175.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 50.2 m -135.48 1.36 2.86 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.226 1.411 . . . . 0.0 114.371 -173.019 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -155.58 176.14 12.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.183 2.193 . . . . 0.0 109.56 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -144.6 150.26 37.15 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.289 1.036 . . . . 0.0 111.767 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 78.2 mt -135.66 144.11 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 126.083 1.753 . . . . 0.0 109.5 -177.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -147.54 168.63 21.47 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.148 1.779 . . . . 0.0 110.376 169.535 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 18.6 p -71.65 163.59 27.48 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 120.659 -1.276 . . . . 0.0 111.702 172.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -55.35 -42.06 73.35 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.272 -0.892 . . . . 0.0 112.308 169.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.25 92.94 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.653 0.781 . . . . 0.0 112.868 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.45 -31.9 72.4 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.442 -0.786 . . . . 0.0 112.66 175.359 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 39.4 t80 . . . . . 0 CA--C 1.54 0.586 0 CA-C-N 119.063 0.847 . . . . 0.0 111.415 169.016 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -66.91 -17.01 64.7 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.246 1.419 . . . . 0.0 113.234 169.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -95.2 14.67 21.42 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.899 2.08 . . . . 0.0 113.386 175.52 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 39.8 t -122.19 142.9 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 124.856 1.263 . . . . 0.0 111.583 -170.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 76.5 mt -114.12 164.35 13.97 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 127.328 2.251 . . . . 0.0 110.868 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -120.95 140.24 52.14 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.875 2.07 . . . . 0.0 107.772 168.103 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.5 t -133.62 142.79 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 C-N-CA 124.776 1.23 . . . . 0.0 109.15 -169.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 12.2 m -132.27 134.05 44.82 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.215 1.406 . . . . 0.0 109.581 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -158.55 157.32 28.6 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.293 1.037 . . . . 0.0 112.561 -169.495 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.83 144.17 78.24 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 123.53 2.82 . . . . 0.0 112.179 168.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -55.2 -24.27 26.3 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.44 -13.96 54.32 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.247 1.419 . . . . 0.0 114.554 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -68.99 156.0 39.37 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.5 1.12 . . . . 0.0 112.877 172.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -129.16 170.11 13.95 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.381 1.872 . . . . 0.0 111.058 174.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.1 m -51.81 -33.53 36.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.788 1.235 . . . . 0.0 111.943 169.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.3 m -64.83 -42.3 95.07 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 175.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -66.31 -31.8 72.81 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.626 -0.671 . . . . 0.0 111.094 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.2 mt -70.98 -43.02 68.92 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.78 0.832 . . . . 0.0 111.395 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -57.47 -44.1 84.6 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.926 -1.109 . . . . 0.0 111.511 169.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -62.45 -33.51 74.96 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 50.7 tp -73.93 -29.72 62.18 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.444 1.098 . . . . 0.0 113.412 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -120.38 -4.39 9.9 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.947 1.832 . . . . 0.0 115.947 -169.736 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 86.5 p -59.42 -20.24 53.46 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 173.405 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -60.77 -9.19 3.68 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.923 1.689 . . . . 0.0 114.87 172.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -119.28 14.97 13.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.745 1.618 . . . . 0.0 113.398 -172.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 89.31 -149.41 20.67 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.484 1.04 . . . . 0.0 112.704 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -62.58 142.55 57.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.482 0.713 . . . . 0.0 111.281 170.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 38.5 pt -142.57 174.16 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.489 1.515 . . . . 0.0 111.698 -176.755 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -138.79 142.37 38.74 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.897 1.279 . . . . 0.0 109.044 168.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 69.8 mt -122.33 124.89 71.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 125.067 1.347 . . . . 0.0 108.471 -176.633 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 75.7 m -135.25 94.83 3.18 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.416 1.486 . . . . 0.0 110.904 -169.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 86.7 m95 -56.27 152.72 10.6 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.325 1.05 . . . . 0.0 113.648 178.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 27.4 pt -129.88 -22.59 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 124.707 1.203 . . . . 0.0 113.206 170.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.43 -174.12 3.88 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.713 2.005 . . . . 0.0 110.233 169.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -74.08 -5.32 40.91 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -176.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 69.5 p -135.44 2.15 2.95 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 119.757 1.162 . . . . 0.0 114.064 -177.246 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 45.5 m -144.51 150.57 37.79 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.411 1.485 . . . . 0.0 113.295 173.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.6 156.89 41.37 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.195 1.398 . . . . 0.0 111.588 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -89.87 151.1 21.92 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.492 0.717 . . . . 0.0 109.874 167.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 63.1 t -138.34 114.53 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 124.137 0.975 . . . . 0.0 110.536 176.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 32.5 m -79.32 138.93 37.9 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.687 1.195 . . . . 0.0 110.533 171.195 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 56.1 mt -113.81 164.49 13.67 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.526 1.13 . . . . 0.0 111.703 175.752 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 22.7 t -55.49 -40.96 72.37 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.478 1.111 . . . . 0.0 113.452 -175.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -146.51 160.86 40.48 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.324 1.85 . . . . 0.0 110.982 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.88 -12.45 30.79 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.334 2.689 . . . . 0.0 114.074 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -61.53 -38.91 89.15 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.983 -1.073 . . . . 0.0 112.445 173.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -76.54 -20.4 56.91 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.069 0.948 . . . . 0.0 113.309 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.42 -44.58 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 124.653 1.181 . . . . 0.0 110.59 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -61.91 -40.47 95.58 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.698 0.799 . . . . 0.0 112.183 174.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 57.0 mt -65.12 -45.7 93.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.482 0.713 . . . . 0.0 110.843 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.5 -36.0 82.33 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 177.705 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 79.0 t -65.52 -40.93 89.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 120.987 -1.07 . . . . 0.0 110.992 170.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -63.13 -39.96 96.19 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.847 0.859 . . . . 0.0 113.156 176.111 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 44.2 p -76.68 -31.05 57.01 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.798 0.839 . . . . 0.0 112.842 -178.798 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.2 t -61.17 -19.58 61.74 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 173.393 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -54.16 -22.63 11.75 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.539 1.535 . . . . 0.0 113.54 169.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -122.73 10.38 9.63 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.903 1.681 . . . . 0.0 113.144 -175.3 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -66.45 157.33 32.29 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.513 1.125 . . . . 0.0 112.83 175.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.43 -5.1 1.24 Allowed 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 50.6 m -135.55 4.47 3.11 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.347 1.459 . . . . 0.0 113.468 -178.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.9 p90 -161.59 175.18 12.35 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.096 2.158 . . . . 0.0 110.213 -177.557 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 54.9 ttt85 -147.44 151.75 36.95 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.442 1.497 . . . . 0.0 111.17 169.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 49.3 mt -132.46 142.29 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 126.019 1.727 . . . . 0.0 110.091 -175.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.7 pt20 -145.34 171.43 14.61 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.304 1.841 . . . . 0.0 110.137 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 44.7 p -72.18 160.85 31.75 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 120.481 -1.387 . . . . 0.0 112.325 174.036 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -55.29 -43.01 74.37 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.5 -0.75 . . . . 0.0 111.565 168.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.75 -38.05 89.68 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.888 0.875 . . . . 0.0 113.31 179.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.04 -45.54 93.12 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.424 -0.798 . . . . 0.0 112.072 173.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 89.2 t80 . . . . . 0 CA--C 1.538 0.511 0 CA-C-N 118.51 0.595 . . . . 0.0 111.817 174.977 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 86.9 mmt-85 . . . . . 0 N--CA 1.488 1.425 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -67.35 -2.72 6.56 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 177.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 37.2 p-80 -117.3 12.86 14.45 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.322 1.849 . . . . 0.0 113.06 175.041 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 45.2 t -116.43 125.81 73.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.635 1.174 . . . . 0.0 111.849 -169.672 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.72 167.97 11.31 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.91 1.684 . . . . 0.0 111.693 169.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -128.13 136.68 51.48 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 127.052 2.141 . . . . 0.0 106.806 166.047 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 11.6 t -132.98 136.86 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.606 1.163 . . . . 0.0 109.131 -169.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 19.0 m -125.89 134.1 51.7 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.055 1.342 . . . . 0.0 109.423 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.9 p90 -156.78 156.98 30.58 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 124.362 1.065 . . . . 0.0 112.462 -168.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.24 145.22 67.18 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.548 2.832 . . . . 0.0 112.193 168.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -55.71 -22.96 26.17 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.362 1.615 . . . . 0.0 115.362 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.71 -12.86 61.42 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.398 1.479 . . . . 0.0 114.329 177.153 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -70.34 156.31 39.48 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.371 1.068 . . . . 0.0 113.115 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -131.82 170.23 15.13 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.387 1.875 . . . . 0.0 111.727 174.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.3 m -48.17 -37.84 16.63 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.199 1.8 . . . . 0.0 111.857 169.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.7 m -62.31 -45.25 94.07 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -64.56 -30.7 71.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.264 0.626 . . . . 0.0 111.529 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 77.1 mt -72.82 -46.45 53.05 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.853 0.861 . . . . 0.0 111.867 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -61.82 -31.9 72.17 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.774 -1.204 . . . . 0.0 112.809 170.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -69.9 -35.82 74.92 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.095 0.862 . . . . 0.0 112.787 172.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.1 -32.74 74.6 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.754 1.222 . . . . 0.0 112.251 175.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -114.02 13.41 18.19 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 -174.032 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 90.6 p -56.91 -26.37 59.01 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 178.938 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.48 -21.96 60.87 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.312 1.445 . . . . 0.0 114.466 174.657 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -92.98 -2.44 55.75 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.785 1.234 . . . . 0.0 113.703 177.008 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 78.84 -45.21 2.68 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 125.911 1.72 . . . . 0.0 114.248 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -145.54 151.31 37.94 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.649 1.58 . . . . 0.0 111.416 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 19.9 pt -149.36 178.94 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 127.28 2.232 . . . . 0.0 110.258 173.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -141.96 144.61 33.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.152 1.381 . . . . 0.0 109.007 167.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 66.0 mt -123.79 137.55 56.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.897 0.879 . . . . 0.0 110.585 -169.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 69.5 m -135.17 95.28 3.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.184 1.794 . . . . 0.0 109.932 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -58.86 152.25 19.74 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.996 0.919 . . . . 0.0 113.233 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 39.2 pt -134.74 -20.94 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.679 1.192 . . . . 0.0 113.524 172.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -153.32 175.6 12.92 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.649 1.179 . . . . 0.0 111.686 173.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -64.8 -13.34 55.21 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.803 1.641 . . . . 0.0 113.569 174.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 42.0 p -133.97 3.16 3.44 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.684 1.594 . . . . 0.0 113.928 -174.067 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 51.8 p -154.86 157.24 37.54 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 171.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.29 157.2 39.77 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.542 1.537 . . . . 0.0 111.831 -175.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -89.83 149.26 22.75 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.457 0.703 . . . . 0.0 110.176 167.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 42.6 t -138.17 111.12 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 124.135 0.974 . . . . 0.0 110.57 -179.485 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 58.5 m -75.81 139.05 41.56 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.355 1.462 . . . . 0.0 111.059 171.206 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 45.7 mt -113.15 159.7 18.99 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.178 1.391 . . . . 0.0 111.436 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 68.3 m -67.17 -26.38 66.61 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -143.09 147.11 39.68 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 124.876 1.271 . . . . 0.0 111.889 176.161 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.1 -33.13 82.64 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 123.896 3.064 . . . . 0.0 114.716 173.928 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.9 -29.5 70.25 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.178 -0.951 . . . . 0.0 113.175 178.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.69 -24.68 64.53 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.155 0.982 . . . . 0.0 112.51 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 66.4 t -62.37 -43.24 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.233 1.013 . . . . 0.0 110.539 175.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -63.44 -39.51 94.66 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.654 0.782 . . . . 0.0 111.894 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 82.6 mt -63.79 -47.39 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.913 0.885 . . . . 0.0 110.645 176.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.24 -39.86 94.81 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.62 -43.08 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.466 0.706 . . . . 0.0 111.324 173.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -62.98 -46.76 86.16 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.022 0.828 . . . . 0.0 112.678 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 29.9 p -74.33 -20.3 60.15 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -175.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 25.5 p -57.8 -24.81 59.06 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 173.694 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -56.49 -20.45 20.26 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.694 1.998 . . . . 0.0 114.016 174.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -109.36 4.79 22.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.312 1.445 . . . . 0.0 113.689 -174.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -64.9 159.69 22.2 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.03 0.932 . . . . 0.0 113.136 176.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -138.43 -2.46 1.79 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.009 1.324 . . . . 0.0 114.051 174.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 76.1 p -148.64 5.95 0.71 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.172 1.389 . . . . 0.0 114.364 -172.052 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -158.99 173.25 16.79 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.479 1.912 . . . . 0.0 110.741 -178.753 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -140.83 154.98 46.45 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.171 1.788 . . . . 0.0 110.982 169.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 62.0 mt -135.93 142.68 38.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.952 1.701 . . . . 0.0 109.058 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -149.96 173.68 13.54 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.222 1.809 . . . . 0.0 110.661 172.593 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 37.6 p -74.65 163.36 27.81 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 120.713 -1.242 . . . . 0.0 112.248 172.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -55.86 -42.02 75.25 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.285 -0.885 . . . . 0.0 112.053 169.25 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.63 91.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.113 0.965 . . . . 0.0 113.27 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -62.79 -43.67 98.18 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.437 -0.789 . . . . 0.0 112.133 172.843 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 87.4 t80 . . . . . 0 CA--C 1.538 0.507 0 CA-C-N 118.699 0.681 . . . . 0.0 111.985 175.32 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 . . . . . 0 N--CA 1.485 1.278 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -61.49 -15.44 37.82 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.137 1.375 . . . . 0.0 114.346 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -106.42 14.91 26.67 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.263 2.225 . . . . 0.0 113.236 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 30.4 t -120.89 143.97 31.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.824 1.249 . . . . 0.0 111.008 -176.434 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 88.9 mt -117.0 164.52 14.59 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.122 2.169 . . . . 0.0 111.124 177.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -123.04 139.31 54.2 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.734 2.014 . . . . 0.0 107.523 167.401 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.31 140.95 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 124.723 1.209 . . . . 0.0 109.792 -169.211 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 5.0 m -132.54 133.75 44.12 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.119 1.368 . . . . 0.0 109.735 -177.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -158.98 157.86 28.51 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 124.156 0.982 . . . . 0.0 112.332 -169.388 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.49 146.28 43.06 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.876 3.051 . . . . 0.0 113.465 170.26 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -53.86 -25.2 18.63 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -62.53 -18.9 62.97 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.211 1.804 . . . . 0.0 114.381 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 17.2 m95 -69.42 157.02 37.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.568 1.147 . . . . 0.0 112.961 176.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -129.38 167.52 17.64 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.16 1.784 . . . . 0.0 111.123 173.498 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.2 m -51.98 -33.08 36.35 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.113 1.365 . . . . 0.0 111.901 170.392 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 70.3 m -64.26 -43.3 95.29 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 174.003 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -66.45 -31.5 72.29 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.536 -0.728 . . . . 0.0 111.231 174.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.0 mt -70.9 -42.91 69.33 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.796 0.838 . . . . 0.0 111.428 175.31 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -60.89 -40.98 95.13 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.99 -1.069 . . . . 0.0 111.797 169.259 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -60.55 -33.3 72.48 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.613 1.097 . . . . 0.0 112.714 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.8 tp -76.23 -30.18 57.82 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.858 1.263 . . . . 0.0 113.86 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -123.65 -13.11 7.56 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 116.662 2.097 . . . . 0.0 116.662 -169.051 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 32.3 t -58.08 -22.19 49.38 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.327 1.421 . . . . 0.0 113.635 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -54.77 -25.83 30.44 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 171.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -86.94 -18.73 30.07 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 177.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 140.22 -159.61 26.19 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.5 1.048 . . . . 0.0 113.496 -179.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -74.77 62.72 1.1 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.401 1.48 . . . . 0.0 112.281 172.072 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 1.2 pp -59.08 168.55 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 126.862 2.065 . . . . 0.0 113.497 178.617 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -130.74 150.59 51.85 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.934 1.294 . . . . 0.0 110.648 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 61.5 mt -130.97 133.19 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.217 1.407 . . . . 0.0 109.077 -174.523 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 45.9 m -134.94 98.21 3.95 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.387 1.475 . . . . 0.0 111.135 -177.5 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -57.84 148.52 25.04 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.778 1.231 . . . . 0.0 113.942 178.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 33.0 pt -135.36 -19.26 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.059 1.343 . . . . 0.0 113.872 170.749 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -152.88 176.93 11.3 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.776 1.231 . . . . 0.0 111.597 172.599 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -64.95 -12.54 50.84 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.895 1.678 . . . . 0.0 113.51 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.7 p -136.97 5.56 2.82 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.225 2.21 . . . . 0.0 113.234 -173.768 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 75.2 m -146.38 138.59 25.05 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.421 1.088 . . . . 0.0 113.156 -172.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.76 157.79 41.34 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.679 1.192 . . . . 0.0 112.398 176.757 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -89.9 154.84 19.55 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.755 0.822 . . . . 0.0 110.027 167.255 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.4 t -137.67 124.3 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.359 1.064 . . . . 0.0 110.15 175.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 7.5 t -93.8 132.71 37.93 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.785 1.234 . . . . 0.0 110.751 177.182 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 50.4 mt -111.85 161.1 16.72 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.352 1.461 . . . . 0.0 111.129 178.265 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 38.5 m -67.79 -25.92 65.83 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -174.143 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -145.55 153.98 52.0 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.187 1.395 . . . . 0.0 111.963 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.17 -20.85 32.36 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.23 2.62 . . . . 0.0 113.632 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -63.17 -35.3 79.83 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.79 -1.194 . . . . 0.0 111.818 171.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -69.35 -28.14 65.95 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.267 -0.896 . . . . 0.0 112.734 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.4 -43.68 98.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.586 0.754 . . . . 0.0 111.151 170.471 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 22.4 tm0? -61.39 -41.62 97.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.75 0.705 . . . . 0.0 111.588 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 95.8 mt -62.19 -47.79 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.368 0.667 . . . . 0.0 111.003 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.79 87.74 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.179 0.9 . . . . 0.0 113.383 178.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.23 -27.6 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.181 0.993 . . . . 0.0 112.117 173.311 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -74.53 -46.85 36.43 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 120.935 -1.103 . . . . 0.0 112.144 169.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 57.4 p -74.34 -21.23 59.79 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -174.342 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 84.8 p -59.49 -23.15 62.53 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -59.67 -17.75 36.57 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.198 1.399 . . . . 0.0 114.102 173.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -100.49 -0.48 37.83 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.961 1.305 . . . . 0.0 113.618 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -67.11 155.59 38.34 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.012 0.925 . . . . 0.0 112.943 176.754 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -138.22 -4.22 1.71 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.218 1.407 . . . . 0.0 112.7 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 70.7 p -141.75 5.54 1.78 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.902 1.681 . . . . 0.0 114.1 -172.893 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -156.68 169.33 24.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.273 1.829 . . . . 0.0 111.055 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 -141.1 149.33 41.44 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.147 2.179 . . . . 0.0 110.411 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 86.8 mt -137.65 142.82 35.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.633 1.573 . . . . 0.0 110.098 -177.226 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -144.22 164.48 30.6 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.51 1.924 . . . . 0.0 109.566 168.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 20.3 p -71.0 162.05 30.08 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 120.374 -1.454 . . . . 0.0 111.775 174.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -58.17 -36.97 73.81 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.265 -0.897 . . . . 0.0 111.834 169.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.73 92.22 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 123.643 0.777 . . . . 0.0 113.068 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.7 -39.75 95.08 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.379 -0.826 . . . . 0.0 112.029 173.428 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 82.5 t80 . . . . . 0 CA--C 1.541 0.63 0 C-N-CA 122.941 0.496 . . . . 0.0 112.067 172.965 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 69.2 mtt85 . . . . . 0 N--CA 1.483 1.189 0 N-CA-C 113.523 0.934 . . . . 0.0 113.523 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.79 -19.75 64.33 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 121.029 -1.044 . . . . 0.0 113.327 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 38.4 p-80 -94.66 12.71 26.76 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.546 2.338 . . . . 0.0 113.795 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 29.3 t -120.11 141.96 37.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.108 1.363 . . . . 0.0 111.656 -171.305 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 65.7 mt -117.13 166.68 11.94 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 127.388 2.275 . . . . 0.0 110.975 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -123.92 142.24 51.32 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 126.779 2.031 . . . . 0.0 107.883 167.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.3 t -134.74 138.6 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 124.999 1.319 . . . . 0.0 109.024 -171.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 3.7 m -125.44 135.79 52.71 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.828 1.251 . . . . 0.0 109.621 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -155.49 153.35 26.36 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 124.689 1.196 . . . . 0.0 112.059 -169.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -52.42 147.51 29.13 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.818 3.012 . . . . 0.0 113.209 169.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -57.95 -18.7 25.14 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.367 1.618 . . . . 0.0 115.367 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -81.27 -15.74 54.64 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.561 1.544 . . . . 0.0 114.0 178.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 6.6 m95 -61.43 151.38 32.72 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.224 0.92 . . . . 0.0 112.323 175.118 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -119.1 165.32 14.31 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.005 1.722 . . . . 0.0 111.869 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.7 m -51.77 -34.57 40.22 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.991 1.316 . . . . 0.0 111.509 168.06 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.8 m -65.99 -41.73 90.7 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 175.405 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -64.98 -31.39 72.6 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.599 -0.688 . . . . 0.0 111.183 173.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 72.8 mt -70.5 -47.41 60.65 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.653 0.781 . . . . 0.0 111.359 174.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -59.91 -32.04 70.38 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.93 -1.106 . . . . 0.0 113.064 171.286 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -69.86 -42.67 73.22 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.148 0.886 . . . . 0.0 112.113 172.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 55.6 tp -62.11 -33.57 74.69 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.162 1.385 . . . . 0.0 112.253 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -108.28 12.91 26.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.663 1.185 . . . . 0.0 113.536 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 23.2 t -56.3 -30.32 62.37 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.026 1.33 . . . . 0.0 113.281 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.64 -14.81 9.25 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.637 1.575 . . . . 0.0 115.081 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -111.26 -4.71 14.86 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.9 1.28 . . . . 0.0 113.684 -175.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 72.86 -31.07 0.75 Allowed Glycine 0 CA--C 1.539 1.556 0 C-N-CA 126.425 1.964 . . . . 0.0 117.196 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -148.07 129.23 14.6 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.862 1.665 . . . . 0.0 110.624 -176.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.8 pt -146.07 173.5 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.556 1.542 . . . . 0.0 112.089 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -142.0 144.5 33.7 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.298 1.439 . . . . 0.0 108.59 167.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 49.7 mt -127.42 133.7 67.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.192 0.997 . . . . 0.0 109.993 -172.057 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 70.6 m -136.9 103.25 5.11 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.551 1.541 . . . . 0.0 110.529 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -60.73 158.85 11.93 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.768 1.227 . . . . 0.0 114.249 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.8 -28.68 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.694 1.197 . . . . 0.0 112.252 171.427 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -154.1 -178.5 7.14 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.878 1.271 . . . . 0.0 111.471 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.74 -19.68 62.7 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.892 1.277 . . . . 0.0 113.065 171.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.8 p -132.31 5.64 4.11 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.99 2.116 . . . . 0.0 113.525 -169.502 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 18.9 m -144.08 139.88 29.17 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.667 1.187 . . . . 0.0 113.126 -175.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.13 155.2 38.42 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.241 1.416 . . . . 0.0 112.074 174.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -89.4 149.74 22.85 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.421 1.088 . . . . 0.0 109.67 167.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 58.2 t -137.3 115.52 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.281 1.032 . . . . 0.0 110.314 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 67.9 m -80.6 142.51 33.98 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.489 1.116 . . . . 0.0 110.838 170.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 68.6 mt -119.76 160.73 22.02 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.118 1.367 . . . . 0.0 110.843 172.517 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 65.4 m -61.57 -27.45 68.64 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.049 1.5 . . . . 0.0 115.049 -175.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -144.37 152.65 54.27 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.139 1.376 . . . . 0.0 111.573 176.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.24 -12.83 36.22 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.891 3.06 . . . . 0.0 114.032 172.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.5 -38.84 88.12 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.749 -1.219 . . . . 0.0 111.683 169.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -74.62 -25.33 59.16 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.637 0.775 . . . . 0.0 112.788 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.85 -44.15 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.437 1.495 . . . . 0.0 111.179 171.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -65.41 -36.18 83.17 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.014 0.925 . . . . 0.0 112.045 178.731 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 61.3 mt -64.72 -47.92 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.316 1.047 . . . . 0.0 110.49 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.38 -34.85 79.12 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.8 -41.14 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 O-C-N 121.058 -1.027 . . . . 0.0 111.11 170.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -62.66 -42.58 99.69 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -72.96 -31.38 64.52 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.739 0.816 . . . . 0.0 113.028 -178.209 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 10.3 t -65.04 -16.39 63.39 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 174.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -55.29 -21.88 16.4 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.383 1.473 . . . . 0.0 114.001 176.734 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -124.79 16.41 8.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.78 1.632 . . . . 0.0 112.994 -175.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.22 159.47 17.65 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.293 1.037 . . . . 0.0 113.113 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -135.8 -8.92 2.12 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.027 1.331 . . . . 0.0 113.098 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 71.4 p -140.54 2.43 1.82 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.497 1.519 . . . . 0.0 114.432 -172.22 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -157.49 176.07 13.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.438 1.895 . . . . 0.0 110.794 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -147.55 147.21 29.86 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.309 1.444 . . . . 0.0 110.827 169.503 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 76.0 mt -129.77 142.05 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 126.237 1.815 . . . . 0.0 109.694 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -146.55 163.14 36.71 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.789 1.636 . . . . 0.0 110.79 170.749 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 19.2 p -71.1 164.97 24.53 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 120.644 -1.285 . . . . 0.0 112.192 173.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -58.61 -39.4 80.35 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 121.038 -1.039 . . . . 0.0 111.983 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.8 -34.29 78.0 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.802 0.841 . . . . 0.0 113.195 177.344 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -71.84 -40.66 68.91 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.349 -0.845 . . . . 0.0 112.142 170.547 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 33.7 t80 . . . . . 0 N--CA 1.47 0.543 0 C-N-CA 124.954 1.302 . . . . 0.0 113.559 177.911 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.9 -17.75 64.87 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -173.609 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 38.1 p-80 -100.17 14.41 30.9 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.434 2.294 . . . . 0.0 113.352 176.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 23.4 t -120.54 133.28 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.665 1.186 . . . . 0.0 111.649 -170.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 94.1 mt -103.81 166.63 10.29 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.842 2.057 . . . . 0.0 111.669 175.691 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -125.32 138.75 54.07 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 127.371 2.268 . . . . 0.0 107.413 167.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.2 t -135.61 138.64 47.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 C-N-CA 124.822 1.249 . . . . 0.0 109.165 -170.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 6.9 m -126.62 131.25 51.52 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.919 1.288 . . . . 0.0 109.23 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -150.51 160.37 32.93 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.678 1.191 . . . . 0.0 112.925 -168.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -54.13 156.59 12.76 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 124.658 3.572 . . . . 0.0 115.32 177.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -58.01 -12.64 3.52 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.396 1.878 . . . . 0.0 115.913 174.979 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -117.63 -1.03 11.71 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.791 1.636 . . . . 0.0 113.848 -177.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 1.7 m0 -66.81 154.28 41.25 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.223 -0.923 . . . . 0.0 111.874 169.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -129.54 166.47 19.61 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.097 1.359 . . . . 0.0 113.278 -174.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.3 m -47.29 -33.38 5.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.909 1.684 . . . . 0.0 112.865 170.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 20.2 p -72.9 -41.06 65.0 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -60.49 -28.23 68.2 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.551 0.614 . . . . 0.0 110.33 168.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.2 mt -78.36 -46.2 20.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.544 0.338 . . . . 0.0 111.782 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -58.11 -39.64 79.15 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.055 -1.028 . . . . 0.0 111.989 169.676 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -64.37 -34.45 78.18 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.166 0.893 . . . . 0.0 112.869 174.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 44.1 tp -71.52 -28.9 64.21 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.172 0.989 . . . . 0.0 113.141 177.455 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -121.7 3.85 10.08 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 -172.164 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 75.3 p -56.77 -24.57 51.22 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.12 -15.06 8.17 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.568 1.547 . . . . 0.0 114.624 173.437 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -106.15 3.55 28.09 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.342 1.457 . . . . 0.0 113.861 -177.611 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 82.55 -45.44 3.38 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.879 1.704 . . . . 0.0 115.572 169.203 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -150.85 143.91 24.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.935 1.294 . . . . 0.0 111.127 177.261 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 24.1 pt -144.78 171.42 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 125.209 1.404 . . . . 0.0 112.076 -175.583 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -138.33 105.68 5.52 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.244 1.018 . . . . 0.0 109.521 167.197 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.9 mt -74.53 135.72 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.094 0.958 . . . . 0.0 108.477 172.046 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.7 m -138.99 96.71 3.16 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.503 1.921 . . . . 0.0 109.523 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -58.18 155.94 10.51 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -173.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 8.5 mt -131.72 -41.1 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.177 1.391 . . . . 0.0 110.054 176.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -156.49 179.89 8.83 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.443 1.497 . . . . 0.0 111.441 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -56.23 -20.26 17.52 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.619 1.968 . . . . 0.0 114.087 173.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.6 p -131.42 4.02 4.29 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.273 1.829 . . . . 0.0 113.778 -173.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 69.5 m -144.4 139.42 28.4 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.12 0.968 . . . . 0.0 112.894 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -149.88 152.02 34.39 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.669 1.188 . . . . 0.0 112.24 175.478 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -89.42 151.73 21.87 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.829 0.852 . . . . 0.0 108.788 167.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 49.3 t -140.51 111.14 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.867 0.867 . . . . 0.0 110.591 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 72.4 m -73.84 143.71 45.8 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.796 0.838 . . . . 0.0 110.629 169.386 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 67.3 mt -118.81 164.63 15.12 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.701 1.6 . . . . 0.0 110.516 171.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 63.3 m -62.71 -28.86 70.24 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -144.35 152.75 54.6 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 124.701 1.2 . . . . 0.0 112.346 -177.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.94 -16.67 32.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.457 2.771 . . . . 0.0 113.807 173.434 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.41 -38.48 90.05 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.946 -1.096 . . . . 0.0 111.813 170.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -67.13 -31.04 71.22 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.259 1.024 . . . . 0.0 112.338 179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 43.4 t -58.28 -40.04 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.986 0.914 . . . . 0.0 111.283 171.162 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -65.77 -38.37 88.87 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.62 -0.675 . . . . 0.0 111.683 178.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 78.8 mt -65.3 -44.51 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.236 1.014 . . . . 0.0 110.669 175.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.21 -41.14 99.1 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.324 -0.86 . . . . 0.0 112.868 176.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 57.8 t -67.52 -31.56 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.147 0.979 . . . . 0.0 112.303 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -69.4 -49.73 52.61 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.028 -1.045 . . . . 0.0 111.854 171.139 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 23.7 p -71.37 -24.46 62.09 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -174.185 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 60.1 p -67.1 -14.29 62.76 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 176.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -59.88 -16.14 26.88 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.81 1.244 . . . . 0.0 113.734 169.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -119.17 10.95 12.21 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.628 1.571 . . . . 0.0 112.777 -172.128 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.68 164.24 10.13 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.97 1.308 . . . . 0.0 112.657 170.052 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -136.53 -27.95 1.03 Allowed 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -177.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 42.9 m -133.4 5.65 3.77 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.673 1.189 . . . . 0.0 113.856 -175.005 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -150.41 176.16 11.18 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.581 1.952 . . . . 0.0 110.468 -176.315 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -144.27 150.77 38.43 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.547 1.139 . . . . 0.0 111.397 173.179 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 34.2 mt -133.87 140.1 47.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.345 1.858 . . . . 0.0 108.541 177.572 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -149.65 172.43 15.06 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.101 1.76 . . . . 0.0 110.319 174.385 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 32.3 p -72.61 163.14 28.54 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.715 -1.241 . . . . 0.0 111.959 171.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -54.54 -41.66 70.02 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.267 -0.896 . . . . 0.0 111.848 169.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.76 -35.76 80.85 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.68 -33.2 73.56 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.024 -1.048 . . . . 0.0 112.926 175.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 81.9 t80 . . . . . 0 CA--C 1.541 0.601 0 O-C-N 121.721 -0.612 . . . . 0.0 111.813 170.46 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -63.04 -14.29 46.28 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 177.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -93.62 7.7 43.7 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.701 1.6 . . . . 0.0 114.0 173.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 19.0 t -117.64 139.07 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.711 1.204 . . . . 0.0 111.772 -170.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.7 mt -113.15 166.3 11.57 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.711 2.004 . . . . 0.0 111.537 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -127.72 140.9 51.78 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.526 2.331 . . . . 0.0 107.88 168.364 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.2 t -136.18 141.04 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.959 1.304 . . . . 0.0 109.498 -169.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 6.7 m -134.14 136.14 43.62 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.724 1.209 . . . . 0.0 109.848 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.7 p90 -158.86 159.04 29.59 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.277 1.031 . . . . 0.0 112.679 -169.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -52.6 147.53 30.27 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 124.225 3.284 . . . . 0.0 114.069 171.319 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -60.72 -12.74 11.41 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 115.854 1.798 . . . . 0.0 115.854 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -75.11 -17.59 60.4 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.879 1.272 . . . . 0.0 113.953 176.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -65.39 154.77 37.43 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -178.692 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -119.79 164.81 15.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 127.044 2.138 . . . . 0.0 111.697 173.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.6 m -55.81 -31.64 62.85 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.163 0.985 . . . . 0.0 110.908 168.039 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.0 m -64.53 -40.85 96.37 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 172.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -66.49 -30.24 70.53 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.613 -0.679 . . . . 0.0 111.202 173.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 49.7 mt -70.5 -44.81 66.86 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.354 0.662 . . . . 0.0 111.542 173.478 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -57.73 -39.61 77.71 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 120.993 -1.067 . . . . 0.0 111.962 169.531 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 64.3 tp60 -67.82 -33.18 74.28 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.075 0.852 . . . . 0.0 113.257 175.936 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.5 tp -69.87 -32.02 70.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.467 1.107 . . . . 0.0 112.725 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -115.96 6.02 14.08 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -172.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 79.2 p -58.54 -23.85 59.24 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.941 1.297 . . . . 0.0 114.349 175.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.23 -13.09 4.33 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.622 1.569 . . . . 0.0 114.38 172.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -114.21 5.23 15.8 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.847 1.659 . . . . 0.0 113.304 -176.721 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 72.02 -122.57 9.08 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.473 1.035 . . . . 0.0 112.576 177.493 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -60.64 128.48 36.81 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.412 1.085 . . . . 0.0 111.862 173.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 28.4 pt -142.67 167.52 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.807 1.643 . . . . 0.0 110.894 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -137.98 99.51 3.91 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.155 1.382 . . . . 0.0 110.537 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 56.3 mt -79.74 143.2 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.612 1.565 . . . . 0.0 109.644 177.265 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 7.9 t -141.14 111.61 6.89 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.937 1.295 . . . . 0.0 111.399 175.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -62.39 154.2 28.91 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 7.3 mt -132.68 -44.34 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.982 1.313 . . . . 0.0 110.115 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -153.03 177.38 10.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.326 1.85 . . . . 0.0 109.416 170.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.26 1.13 2.3 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -174.784 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 69.1 p -138.09 5.29 2.54 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 127.259 2.224 . . . . 0.0 113.199 -175.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 88.2 p -154.2 149.36 26.94 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.39 152.48 33.16 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.109 1.364 . . . . 0.0 111.919 -176.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -89.42 153.96 20.43 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 166.739 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 40.6 t -139.54 109.73 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.548 0.739 . . . . 0.0 110.081 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 24.7 m -77.33 132.76 38.75 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.358 1.063 . . . . 0.0 109.53 168.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 77.0 mt -112.35 158.59 19.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.997 1.319 . . . . 0.0 110.516 176.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 58.5 m -68.12 -21.5 64.94 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -174.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -143.28 150.75 52.99 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 124.896 1.278 . . . . 0.0 111.751 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.74 -16.54 37.7 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.463 2.775 . . . . 0.0 113.747 175.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -65.58 -36.51 83.98 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.038 -1.039 . . . . 0.0 112.161 171.061 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -69.35 -31.88 70.6 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.456 1.102 . . . . 0.0 112.073 -178.459 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.01 -42.01 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.806 1.242 . . . . 0.0 111.462 171.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 52.8 mm-40 -64.52 -39.17 93.29 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.886 -0.509 . . . . 0.0 111.697 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.98 -48.29 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 124.218 1.007 . . . . 0.0 110.507 177.328 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.52 -36.97 85.54 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.4 t -64.55 -40.14 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 121.188 -0.945 . . . . 0.0 111.194 171.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -63.48 -47.66 80.86 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.774 0.715 . . . . 0.0 112.58 175.301 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.7 p -69.54 -29.51 67.12 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -175.408 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 11.1 t -62.61 -18.81 62.94 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -60.29 -16.55 35.37 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -123.53 8.17 8.95 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.765 1.626 . . . . 0.0 112.724 -173.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -66.84 155.29 38.7 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.107 1.363 . . . . 0.0 112.74 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -133.61 -9.56 2.81 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.681 1.193 . . . . 0.0 113.994 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 40.4 m -136.87 6.51 2.91 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.205 1.402 . . . . 0.0 113.588 -175.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -160.97 171.84 17.97 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.539 1.936 . . . . 0.0 110.576 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -141.61 151.21 42.92 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.425 1.89 . . . . 0.0 110.451 169.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 62.0 mt -132.7 142.8 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 126.189 1.796 . . . . 0.0 109.6 -179.187 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -144.6 164.47 30.84 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.02 1.728 . . . . 0.0 110.02 169.703 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 32.6 p -72.0 164.78 25.51 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 120.604 -1.31 . . . . 0.0 112.065 172.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -59.27 -39.37 82.66 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.943 -1.098 . . . . 0.0 112.095 169.303 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -63.6 -36.91 85.35 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.64 0.776 . . . . 0.0 112.845 176.126 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -66.23 -47.14 74.8 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.424 -0.798 . . . . 0.0 111.854 169.757 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 42.4 t80 . . . . . 0 N--CA 1.469 0.482 0 CA-C-N 118.687 0.676 . . . . 0.0 112.378 179.851 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.1 mmt-85 . . . . . 0 N--CA 1.483 1.188 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -62.36 -23.13 66.63 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.074 0.95 . . . . 0.0 113.492 179.035 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -99.99 12.84 35.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.834 2.054 . . . . 0.0 113.227 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 38.3 t -118.96 137.28 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.746 1.218 . . . . 0.0 111.818 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 61.3 mt -117.33 166.26 12.51 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 127.121 2.168 . . . . 0.0 110.762 175.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -124.46 142.33 51.4 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 127.362 2.265 . . . . 0.0 107.935 168.316 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 9.2 t -134.03 138.29 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.638 1.175 . . . . 0.0 109.235 -173.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.3 m -123.09 135.16 54.27 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.858 1.263 . . . . 0.0 109.898 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -158.7 157.3 28.4 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.485 1.114 . . . . 0.0 112.512 -170.277 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.18 146.03 73.31 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.783 2.989 . . . . 0.0 112.485 168.423 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -58.44 -18.86 31.75 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 -177.258 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -64.34 -19.25 65.33 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.724 1.209 . . . . 0.0 113.913 175.003 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 16.3 m95 -67.39 162.46 22.95 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.471 1.108 . . . . 0.0 113.151 175.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -143.1 169.92 16.69 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 127.255 2.222 . . . . 0.0 110.947 178.623 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.2 m -51.45 -30.79 20.84 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.292 1.837 . . . . 0.0 112.121 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 14.4 p -74.76 -43.04 56.94 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 177.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -61.15 -26.09 67.46 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.91 -0.494 . . . . 0.0 110.702 169.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 76.1 mt -78.78 -44.51 23.07 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 122.772 0.429 . . . . 0.0 111.477 176.403 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -57.14 -37.22 71.71 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.029 -1.045 . . . . 0.0 112.143 169.262 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -68.45 -37.75 80.5 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.943 0.897 . . . . 0.0 113.058 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 59.6 tp -68.36 -28.49 67.17 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.328 1.051 . . . . 0.0 112.975 176.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -117.23 8.74 13.27 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -172.01 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 81.8 p -58.14 -27.26 63.61 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.68 -18.23 40.5 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.243 1.417 . . . . 0.0 114.63 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -94.11 0.58 55.94 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.878 1.271 . . . . 0.0 114.267 -177.098 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.97 -45.85 3.39 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.837 1.684 . . . . 0.0 115.182 169.517 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -150.55 133.83 16.27 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.927 1.291 . . . . 0.0 110.78 175.375 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 15.4 pt -143.48 171.93 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.468 1.507 . . . . 0.0 111.367 -174.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -138.77 152.14 47.68 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.723 1.609 . . . . 0.0 110.302 169.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 76.2 mt -134.08 139.64 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.082 1.353 . . . . 0.0 109.707 -169.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 7.0 t -144.42 107.24 4.46 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.047 0.939 . . . . 0.0 112.588 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -63.23 148.89 46.87 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 37.0 pt -134.8 -20.93 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.939 1.296 . . . . 0.0 113.714 171.714 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -153.19 178.77 9.38 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.842 1.257 . . . . 0.0 111.229 173.311 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -66.84 -15.46 63.63 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.59 1.156 . . . . 0.0 112.698 174.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 39.5 p -132.57 8.47 4.22 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.656 1.982 . . . . 0.0 112.976 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 3.7 m -149.34 142.67 25.18 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.564 1.146 . . . . 0.0 113.543 -177.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.29 160.47 43.79 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.514 1.526 . . . . 0.0 111.377 174.446 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -89.34 154.57 19.98 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.808 0.843 . . . . 0.0 110.116 168.425 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 60.9 t -133.8 112.23 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 124.543 1.137 . . . . 0.0 109.164 171.687 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 37.7 m -85.7 135.11 33.89 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.655 1.582 . . . . 0.0 109.945 172.19 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 79.4 mt -118.64 164.01 15.96 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.973 1.309 . . . . 0.0 111.458 -177.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 58.1 m -69.44 -22.36 63.67 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -177.31 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -146.75 151.32 42.11 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.185 1.394 . . . . 0.0 112.351 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.19 -19.53 33.95 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.481 2.787 . . . . 0.0 113.303 173.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -64.09 -36.27 83.46 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.601 -1.312 . . . . 0.0 111.897 169.905 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -68.98 -31.7 70.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.061 0.944 . . . . 0.0 112.244 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 86.8 t -57.7 -46.38 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 125.09 1.356 . . . . 0.0 110.753 172.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -63.46 -41.67 98.61 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.263 0.625 . . . . 0.0 112.223 177.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 95.6 mt -62.51 -44.04 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.925 0.89 . . . . 0.0 111.213 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -65.23 -39.45 92.74 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.074 -1.016 . . . . 0.0 113.082 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 80.6 t -65.54 -40.94 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 121.189 -0.944 . . . . 0.0 111.49 174.044 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -62.01 -48.11 81.78 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.353 1.061 . . . . 0.0 112.533 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 25.4 p -73.16 -27.96 61.96 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.025 0.93 . . . . 0.0 113.151 -175.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.1 t -64.65 -14.91 60.22 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 171.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -60.75 -14.38 20.9 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.686 1.194 . . . . 0.0 113.431 169.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -114.12 8.26 16.92 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.493 1.917 . . . . 0.0 112.871 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.66 160.96 21.57 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.857 1.263 . . . . 0.0 113.122 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.66 -7.82 1.1 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 32.6 m -140.89 8.73 2.12 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.135 1.374 . . . . 0.0 113.631 -178.708 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 55.6 p90 -160.01 173.89 15.18 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.243 1.817 . . . . 0.0 110.841 -176.402 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -147.73 143.47 27.6 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.036 1.334 . . . . 0.0 110.826 169.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 71.8 mt -120.35 137.18 54.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 126.222 1.809 . . . . 0.0 109.322 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -147.21 169.06 20.15 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.106 1.363 . . . . 0.0 111.293 174.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 43.9 p -71.73 162.66 29.1 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.945 -1.097 . . . . 0.0 112.652 176.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -56.28 -37.08 69.36 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.605 0.762 . . . . 0.0 112.322 169.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -68.02 -40.0 83.02 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.046 0.938 . . . . 0.0 113.152 176.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -67.77 -32.83 73.68 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.045 -1.034 . . . . 0.0 112.505 174.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 21.2 t80 . . . . . 0 CA--C 1.541 0.597 0 C-N-CA 124.064 0.946 . . . . 0.0 111.796 170.327 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 78.7 mtm-85 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -63.95 -16.36 61.35 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.466 1.107 . . . . 0.0 113.521 174.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -89.12 11.0 19.79 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.912 2.085 . . . . 0.0 113.83 172.301 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 44.1 t -121.96 137.23 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 125.169 1.388 . . . . 0.0 110.734 -176.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.7 mt -98.73 162.67 12.99 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 125.871 1.668 . . . . 0.0 111.95 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -118.34 138.45 52.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 127.658 2.383 . . . . 0.0 106.287 166.335 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.8 t -136.33 139.98 44.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 124.233 1.013 . . . . 0.0 109.417 -169.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.7 m -131.24 134.04 46.05 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.18 1.392 . . . . 0.0 109.699 -178.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -157.5 158.43 30.65 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 124.273 1.029 . . . . 0.0 112.504 -169.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -55.81 144.76 75.67 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.318 2.679 . . . . 0.0 111.923 168.785 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -55.39 -24.4 29.71 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 115.316 1.598 . . . . 0.0 115.316 -176.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -63.15 -21.21 66.05 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.149 1.379 . . . . 0.0 113.782 178.008 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 13.4 m95 -63.69 152.74 38.27 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.081 0.953 . . . . 0.0 112.547 174.533 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 43.2 mttm -133.56 171.82 13.57 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.211 1.804 . . . . 0.0 111.653 176.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.1 m -50.62 -35.01 28.36 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.341 1.456 . . . . 0.0 112.338 172.13 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.5 m -65.07 -42.4 94.2 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 175.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.12 -31.45 72.32 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.623 -0.673 . . . . 0.0 111.246 174.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 78.1 mt -70.91 -44.51 66.07 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.884 0.874 . . . . 0.0 111.507 175.178 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -57.28 -41.97 80.77 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.24 -0.912 . . . . 0.0 111.938 169.412 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.25 -39.07 92.16 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 118.808 0.731 . . . . 0.0 112.947 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.0 tp -65.98 -35.05 79.53 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.618 1.167 . . . . 0.0 112.398 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -111.71 5.83 19.45 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -173.206 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 24.5 t -53.63 -30.64 43.77 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.399 1.479 . . . . 0.0 113.515 173.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.6 -12.15 3.79 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 125.778 1.631 . . . . 0.0 115.129 175.18 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -113.53 3.08 15.58 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.662 1.585 . . . . 0.0 113.534 -177.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 93.74 -151.62 20.39 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.476 1.036 . . . . 0.0 112.686 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -62.28 150.75 38.34 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.584 0.754 . . . . 0.0 112.286 170.148 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 27.4 pt -144.76 179.21 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 126.061 1.744 . . . . 0.0 111.245 -174.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -137.95 143.53 40.78 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.81 1.244 . . . . 0.0 109.338 168.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.9 mt -127.5 130.99 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.723 1.209 . . . . 0.0 109.456 -171.987 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 63.7 m -137.58 98.94 3.81 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.447 1.499 . . . . 0.0 110.993 -174.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 94.9 m95 -57.94 152.44 16.23 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.508 1.123 . . . . 0.0 113.923 179.301 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 36.5 pt -134.05 -22.31 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.778 1.231 . . . . 0.0 113.401 169.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -154.1 178.2 10.23 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.395 1.078 . . . . 0.0 111.982 174.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -66.23 -14.57 62.14 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.756 1.622 . . . . 0.0 113.189 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.2 p -132.76 8.09 4.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.261 1.824 . . . . 0.0 113.434 -175.528 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 58.0 p -156.75 151.98 26.41 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.84 162.08 41.52 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.656 1.582 . . . . 0.0 112.051 -177.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -94.61 150.58 20.09 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.13 0.972 . . . . 0.0 110.124 167.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 47.5 t -138.99 113.79 8.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.318 1.047 . . . . 0.0 110.848 177.476 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 50.9 m -76.48 136.22 39.37 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.963 1.305 . . . . 0.0 111.466 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 74.0 mt -118.57 163.92 16.07 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.582 1.553 . . . . 0.0 110.236 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 50.9 m -69.6 -23.45 63.52 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -174.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -148.19 146.39 23.13 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.752 1.221 . . . . 0.0 112.959 -176.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.69 -29.99 73.49 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.786 2.99 . . . . 0.0 114.177 168.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.0 mp0 -60.89 -37.21 81.4 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.944 -1.097 . . . . 0.0 112.073 174.191 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -70.19 -36.38 74.58 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.379 -0.826 . . . . 0.0 111.62 175.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 15.1 t -58.86 -47.84 88.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.708 0.803 . . . . 0.0 111.223 170.255 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.72 -41.33 90.6 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.519 0.599 . . . . 0.0 112.255 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 82.8 mt -62.56 -50.55 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.479 0.712 . . . . 0.0 110.983 174.346 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.92 -36.28 82.85 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 62.6 t -65.35 -41.0 90.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.386 -0.821 . . . . 0.0 111.048 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -64.1 -45.63 87.77 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.14 0.882 . . . . 0.0 112.814 175.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 49.1 p -72.09 -22.07 61.4 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 25.1 p -60.14 -17.33 39.67 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 175.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -52.82 -22.97 6.02 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.506 1.922 . . . . 0.0 113.717 169.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -123.9 20.51 9.2 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.993 1.717 . . . . 0.0 112.715 -175.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.79 -37.75 88.55 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 52.91 -20.68 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 130.014 3.326 . . . . 0.0 118.819 -176.274 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 51.1 m -136.2 3.63 2.88 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.4 1.48 . . . . 0.0 114.027 -173.3 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -156.42 177.72 11.14 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.103 2.161 . . . . 0.0 109.85 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -143.76 150.22 38.27 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.929 1.292 . . . . 0.0 111.022 175.582 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 92.0 mt -129.52 145.37 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.554 1.542 . . . . 0.0 110.079 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -141.16 170.19 16.19 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.799 2.44 . . . . 0.0 108.731 172.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 31.9 p -79.29 163.92 24.53 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.495 -1.378 . . . . 0.0 110.069 167.126 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -55.95 -43.32 77.35 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.378 -0.826 . . . . 0.0 111.678 169.214 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -67.85 -38.88 83.7 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.281 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -62.64 -38.97 92.36 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.534 1.534 . . . . 0.0 111.769 176.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 93.2 t80 . . . . . 0 CA--C 1.54 0.572 0 C-N-CA 123.318 0.647 . . . . 0.0 112.436 170.708 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? . . . . . 0 N--CA 1.485 1.297 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -65.73 -21.91 66.56 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.238 1.015 . . . . 0.0 113.684 -176.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 -95.0 12.99 26.49 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.425 1.89 . . . . 0.0 113.672 176.295 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 38.2 t -116.98 134.12 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.422 1.089 . . . . 0.0 111.362 -170.031 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 89.8 mt -102.2 164.96 11.4 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.593 1.957 . . . . 0.0 111.24 174.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -124.05 138.04 54.5 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 127.196 2.198 . . . . 0.0 107.34 167.657 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -135.42 138.49 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.695 1.198 . . . . 0.0 109.387 -169.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 10.1 m -127.05 136.03 51.63 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.221 1.408 . . . . 0.0 109.501 -177.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -159.91 158.93 27.3 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 124.128 0.971 . . . . 0.0 113.131 -168.901 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -58.02 146.42 87.48 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.464 2.776 . . . . 0.0 111.346 167.241 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.62 -21.29 38.47 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -175.861 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -62.44 -22.47 66.22 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.697 1.599 . . . . 0.0 113.985 174.084 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.0 m95 -62.96 148.91 46.14 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 122.07 0.938 . . . . 0.0 113.068 173.586 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 25.4 mtmm -132.73 166.19 22.78 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.457 1.903 . . . . 0.0 111.377 -172.873 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.5 m -52.75 -33.68 49.34 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.406 1.083 . . . . 0.0 111.837 169.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 75.5 m -66.61 -45.88 77.69 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.492 1.117 . . . . 0.0 113.912 173.081 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.54 -34.49 77.91 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.508 -0.745 . . . . 0.0 111.079 175.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 77.3 mt -67.42 -43.86 80.18 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.251 1.02 . . . . 0.0 111.278 173.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.48 -42.09 86.72 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.112 -0.993 . . . . 0.0 112.507 170.67 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -64.97 -30.53 71.53 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.168 0.894 . . . . 0.0 113.191 175.065 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 51.6 tp -74.51 -29.88 61.58 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.554 1.142 . . . . 0.0 113.262 175.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -122.01 -4.34 9.05 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -169.811 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 83.0 p -57.96 -23.27 53.0 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 120.064 1.302 . . . . 0.0 114.256 174.053 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.13 -14.63 7.25 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.64 1.576 . . . . 0.0 114.345 171.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -109.86 3.07 20.29 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.888 1.675 . . . . 0.0 113.309 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 101.87 -158.53 18.43 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.822 1.201 . . . . 0.0 112.801 -176.6 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -63.53 152.89 37.33 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.428 0.691 . . . . 0.0 112.199 170.036 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 31.4 pt -143.93 174.64 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.485 1.514 . . . . 0.0 111.659 -173.971 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -137.24 151.57 48.88 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.433 1.493 . . . . 0.0 110.177 168.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 71.5 mt -136.17 131.19 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 124.479 1.112 . . . . 0.0 110.303 -169.473 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 51.7 m -137.54 103.73 5.13 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.131 1.772 . . . . 0.0 109.763 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 61.4 m95 -75.32 160.44 30.32 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.54 -0.725 . . . . 0.0 112.852 -174.085 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 29.9 pt -135.48 -18.94 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.807 1.243 . . . . 0.0 113.677 175.682 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -151.65 179.05 8.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.651 1.18 . . . . 0.0 111.737 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -69.23 -10.8 59.48 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.563 1.545 . . . . 0.0 113.05 170.778 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 39.9 p -135.43 3.34 3.06 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.839 1.656 . . . . 0.0 113.929 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 89.1 p -155.15 155.37 33.83 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 170.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -154.15 160.37 41.86 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.195 1.398 . . . . 0.0 112.473 -176.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -91.76 148.88 21.92 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.907 0.883 . . . . 0.0 110.675 168.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 48.8 t -136.42 111.78 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.808 1.243 . . . . 0.0 110.28 178.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 69.8 m -79.07 115.57 18.83 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.666 1.586 . . . . 0.0 110.575 173.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 65.7 mt -82.73 163.61 21.19 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.384 0.673 . . . . 0.0 111.02 169.48 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 87.5 p -67.47 -21.57 65.52 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 176.608 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -147.76 145.03 20.03 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.445 1.498 . . . . 0.0 111.691 -177.528 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -71.54 -18.07 29.59 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.411 2.741 . . . . 0.0 113.372 172.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -62.45 -26.9 68.76 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.043 -1.036 . . . . 0.0 112.789 172.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -92.97 -17.62 23.71 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.546 1.138 . . . . 0.0 113.012 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 28.9 t -57.39 -45.28 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.748 1.219 . . . . 0.0 110.973 171.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -61.73 -34.59 76.09 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.47 0.708 . . . . 0.0 112.753 177.218 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 47.6 mt -68.23 -46.09 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.613 0.765 . . . . 0.0 110.367 178.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.73 -40.67 97.91 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.432 -0.792 . . . . 0.0 112.725 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 73.1 t -67.98 -32.31 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.014 0.926 . . . . 0.0 112.441 175.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -68.96 -47.91 64.47 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.099 -1.001 . . . . 0.0 112.07 171.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 24.3 p -76.23 -22.81 54.77 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -172.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 55.8 p -61.17 -18.23 57.07 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 175.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -55.59 -19.84 11.59 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.015 1.726 . . . . 0.0 113.601 169.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -122.99 18.76 10.09 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.14 1.776 . . . . 0.0 112.671 -175.09 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -60.62 162.94 5.9 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.522 1.529 . . . . 0.0 113.913 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -129.74 -15.21 3.96 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -171.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 14.9 t -154.95 10.93 0.35 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.034 1.334 . . . . 0.0 112.75 -176.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -158.07 175.39 13.86 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.124 1.37 . . . . 0.0 111.913 -169.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -145.6 152.44 39.68 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.961 1.704 . . . . 0.0 110.402 169.754 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 42.2 mt -136.17 142.71 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.44 1.496 . . . . 0.0 110.317 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -146.9 169.13 19.79 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.852 2.061 . . . . 0.0 109.808 169.624 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 16.8 p -71.8 164.63 25.65 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 120.038 -1.664 . . . . 0.0 112.404 171.758 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -56.28 -42.25 77.18 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.105 -0.997 . . . . 0.0 111.856 169.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.39 87.19 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.687 0.795 . . . . 0.0 112.94 177.488 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -64.37 -41.37 96.73 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.352 -0.843 . . . . 0.0 111.965 172.643 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 66.1 t80 . . . . . 0 CA--C 1.538 0.509 0 CA-C-N 118.973 0.806 . . . . 0.0 111.677 172.72 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.33 -12.72 44.86 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.082 1.353 . . . . 0.0 114.298 -178.394 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -115.28 13.46 16.67 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.187 2.195 . . . . 0.0 113.062 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 54.7 t -114.24 125.02 71.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.606 1.162 . . . . 0.0 111.153 -170.549 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.6 mt -92.23 164.11 13.67 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.374 1.47 . . . . 0.0 111.79 170.372 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -122.41 134.76 54.6 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 127.19 2.196 . . . . 0.0 106.663 166.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.8 t -130.18 136.36 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 125.111 1.364 . . . . 0.0 109.022 -169.344 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 11.6 m -129.66 135.57 48.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.081 1.353 . . . . 0.0 109.422 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -158.9 158.38 29.04 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 123.904 0.881 . . . . 0.0 112.788 -169.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -56.46 143.23 88.09 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 122.976 2.451 . . . . 0.0 110.82 166.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -58.13 -19.45 32.64 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -176.171 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -61.52 -21.37 64.17 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.171 1.388 . . . . 0.0 113.946 174.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -64.02 151.1 43.83 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.801 0.84 . . . . 0.0 112.541 172.346 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -136.64 167.66 20.99 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.044 1.738 . . . . 0.0 111.568 179.055 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.9 m -51.62 -36.38 45.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.242 1.417 . . . . 0.0 112.817 177.594 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 72.5 m -67.63 -39.12 84.67 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 176.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -67.38 -31.7 72.11 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.319 -0.863 . . . . 0.0 110.965 173.63 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.3 mt -71.18 -46.24 61.77 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.068 0.947 . . . . 0.0 111.223 176.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -57.16 -37.87 72.72 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.029 -1.044 . . . . 0.0 112.846 171.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -69.72 -37.41 76.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.092 0.957 . . . . 0.0 113.31 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 66.2 tp -62.83 -34.25 76.93 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.559 1.143 . . . . 0.0 112.233 176.691 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -105.23 5.95 32.53 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 -176.763 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 21.4 t -54.93 -29.27 55.93 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.908 1.283 . . . . 0.0 113.406 176.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.82 -13.02 5.09 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.81 1.644 . . . . 0.0 115.21 173.203 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -117.61 5.74 12.41 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.702 1.601 . . . . 0.0 113.168 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 78.19 -148.47 32.9 Favored Glycine 0 CA--C 1.535 1.314 0 O-C-N 121.291 -0.88 . . . . 0.0 112.992 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -59.67 142.5 52.88 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.218 1.007 . . . . 0.0 112.678 177.678 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 10.2 pt -143.59 177.86 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 126.29 1.836 . . . . 0.0 111.287 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -132.57 144.85 50.67 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.634 1.174 . . . . 0.0 110.048 169.487 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.1 mt -126.41 131.85 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.157 1.383 . . . . 0.0 109.044 -172.031 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 56.8 m -134.92 96.43 3.52 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.799 1.64 . . . . 0.0 110.755 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -57.46 150.03 19.59 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.256 1.022 . . . . 0.0 113.209 177.326 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 38.1 pt -133.16 -19.13 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.658 1.183 . . . . 0.0 113.237 170.117 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -152.06 170.87 18.87 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.247 1.419 . . . . 0.0 111.785 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -61.46 -17.52 54.83 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.16 1.784 . . . . 0.0 113.097 170.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 72.8 p -130.04 4.1 4.86 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.979 1.712 . . . . 0.0 114.69 -176.631 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 98.7 p -154.74 157.09 37.5 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 174.278 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.69 163.18 40.16 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.771 1.629 . . . . 0.0 112.207 -177.075 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -98.26 151.36 20.56 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.425 1.09 . . . . 0.0 110.18 167.818 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 89.6 t -139.32 117.85 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.05 0.94 . . . . 0.0 111.088 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 73.2 m -83.16 116.29 22.29 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.55 1.54 . . . . 0.0 110.581 173.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 64.0 mt -85.65 160.4 19.59 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.169 0.987 . . . . 0.0 111.649 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 93.7 p -73.01 -19.83 61.12 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -142.27 149.14 50.59 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.48 1.512 . . . . 0.0 110.925 174.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -70.25 -23.71 28.26 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.943 2.428 . . . . 0.0 113.645 179.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -63.68 -30.05 71.2 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.944 -1.097 . . . . 0.0 112.679 175.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -69.56 -24.44 63.7 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.09 1.356 . . . . 0.0 112.685 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.69 -47.46 91.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.398 1.079 . . . . 0.0 110.987 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -62.13 -37.94 87.06 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.103 0.561 . . . . 0.0 112.068 177.674 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 68.0 mt -62.04 -54.72 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.732 0.813 . . . . 0.0 110.143 176.499 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.15 86.13 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -178.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 65.0 t -63.8 -45.09 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.239 -0.913 . . . . 0.0 110.922 172.899 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.73 -45.93 91.81 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.72 0.808 . . . . 0.0 112.93 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.9 p -70.17 -22.78 62.93 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.269 1.028 . . . . 0.0 113.513 -177.287 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 47.5 m -90.0 -6.56 55.47 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -177.258 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt -56.41 -16.4 5.7 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 172.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -126.49 9.93 7.22 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.967 1.707 . . . . 0.0 113.035 -173.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.4 156.16 33.14 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.801 1.241 . . . . 0.0 112.795 177.358 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -131.28 -6.74 3.81 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 43.0 m -132.3 1.78 3.83 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.204 1.402 . . . . 0.0 113.511 -177.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 45.8 p90 -163.02 174.39 12.35 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.812 2.445 . . . . 0.0 109.621 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -147.6 148.21 30.88 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.567 1.547 . . . . 0.0 110.868 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 74.7 mt -131.7 144.98 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 125.684 1.593 . . . . 0.0 110.505 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -147.17 170.56 16.97 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.933 2.093 . . . . 0.0 109.87 171.329 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 20.9 p -73.5 162.92 28.72 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.576 -1.328 . . . . 0.0 111.716 172.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -55.1 -41.15 71.24 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.409 -0.807 . . . . 0.0 112.156 169.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -70.02 -38.02 75.78 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 179.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -64.38 -41.27 96.78 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.413 -0.805 . . . . 0.0 111.698 173.661 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 25.5 t80 . . . . . 0 CA--C 1.541 0.6 0 C-N-CA 123.423 0.689 . . . . 0.0 111.791 172.089 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 . . . . . 0 N--CA 1.483 1.22 0 CA-C-O 121.471 0.653 . . . . 0.0 112.699 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -59.74 -22.23 61.79 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.69 1.196 . . . . 0.0 113.782 176.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 -82.53 7.54 14.2 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.545 1.938 . . . . 0.0 114.285 173.786 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 19.6 t -123.39 140.79 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 125.064 1.345 . . . . 0.0 111.509 -170.704 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 82.2 mt -115.43 164.69 13.92 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 127.573 2.349 . . . . 0.0 110.499 176.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -122.88 140.86 52.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.556 1.942 . . . . 0.0 108.246 168.797 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.5 t -133.47 138.16 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 124.772 1.229 . . . . 0.0 109.202 -170.445 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 12.1 m -128.19 137.91 52.25 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.142 1.377 . . . . 0.0 109.511 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -158.8 158.66 29.38 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.184 0.994 . . . . 0.0 112.38 -169.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -54.98 142.51 76.11 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.258 2.639 . . . . 0.0 111.89 168.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -57.0 -21.22 28.99 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.61 -20.66 66.4 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.013 1.325 . . . . 0.0 114.006 174.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -64.81 151.79 44.47 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.817 0.847 . . . . 0.0 112.194 173.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -133.26 171.9 13.41 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.902 1.681 . . . . 0.0 112.054 177.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.7 m -50.7 -35.03 29.13 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.475 1.51 . . . . 0.0 112.399 174.029 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.6 m -63.9 -44.76 92.04 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 174.72 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -65.48 -31.14 72.05 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.353 0.661 . . . . 0.0 111.391 175.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 83.6 mt -72.2 -45.87 58.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.804 0.842 . . . . 0.0 111.587 176.313 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.1 -36.17 74.69 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.101 -0.999 . . . . 0.0 112.616 170.189 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -68.28 -39.37 82.17 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.886 0.766 . . . . 0.0 112.842 174.2 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 48.4 tp -65.99 -40.82 91.51 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.713 1.205 . . . . 0.0 112.028 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -99.62 9.71 42.66 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.022 0.929 . . . . 0.0 113.471 -177.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 21.7 t -54.84 -31.48 59.52 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.459 1.504 . . . . 0.0 113.599 177.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.48 -14.0 6.87 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.585 1.554 . . . . 0.0 115.081 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -106.42 0.77 25.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.261 1.425 . . . . 0.0 113.767 -177.474 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.86 -47.19 3.26 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 126.097 1.808 . . . . 0.0 115.81 169.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -144.07 137.64 27.72 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.421 1.489 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 22.1 pt -146.5 174.92 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.386 1.474 . . . . 0.0 111.851 -172.771 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -143.8 148.04 35.0 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.942 1.297 . . . . 0.0 109.071 167.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 49.8 mt -130.9 136.28 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.257 1.023 . . . . 0.0 110.095 -173.205 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 37.5 m -135.13 102.75 5.3 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.745 1.618 . . . . 0.0 110.652 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -59.32 150.47 25.97 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.024 0.93 . . . . 0.0 113.486 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 36.8 pt -135.28 -21.07 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.632 1.173 . . . . 0.0 113.874 170.789 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -152.27 178.97 8.94 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.684 1.194 . . . . 0.0 112.013 175.541 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -68.27 -14.09 62.73 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.752 1.221 . . . . 0.0 113.234 173.175 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.2 p -132.94 3.52 3.75 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.637 1.575 . . . . 0.0 113.769 -172.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 97.1 p -154.26 155.91 36.07 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 174.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.47 159.51 42.32 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.025 1.73 . . . . 0.0 111.61 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -89.8 150.16 22.38 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.68 0.792 . . . . 0.0 110.28 167.885 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 60.4 t -137.82 121.36 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.921 1.288 . . . . 0.0 110.235 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 74.7 m -89.12 142.37 27.7 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.871 1.268 . . . . 0.0 110.929 173.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 82.3 mt -125.54 155.69 40.22 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.441 1.496 . . . . 0.0 110.511 175.202 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 67.0 m -68.84 -24.26 64.35 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -171.394 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -144.85 154.7 55.61 Favored Pre-proline 0 N--CA 1.474 0.732 0 C-N-CA 124.875 1.27 . . . . 0.0 112.503 -177.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.07 -21.47 27.43 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.109 2.539 . . . . 0.0 113.007 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.33 -40.66 97.06 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.223 -0.923 . . . . 0.0 111.376 169.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -66.42 -39.9 89.23 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.308 -0.87 . . . . 0.0 111.54 177.153 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 93.3 t -59.06 -47.76 88.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.449 1.1 . . . . 0.0 110.837 171.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -62.3 -39.5 93.22 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.516 0.726 . . . . 0.0 112.812 177.344 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.84 -46.16 97.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.757 0.823 . . . . 0.0 111.02 174.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.3 -38.58 89.93 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.117 0.872 . . . . 0.0 112.882 177.015 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.1 t -66.58 -37.25 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.187 0.995 . . . . 0.0 112.088 172.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -71.22 -31.0 67.04 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.23 -0.919 . . . . 0.0 113.281 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 23.9 p -91.58 -18.8 23.5 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -174.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 67.5 p -67.37 -21.61 65.61 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -61.78 -13.06 20.21 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -134.54 27.91 3.67 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.184 1.794 . . . . 0.0 112.729 174.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -54.95 150.24 10.48 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.26 1.424 . . . . 0.0 113.798 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -72.17 -37.6 69.3 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.566 1.146 . . . . 0.0 113.8 -174.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 32.8 t -164.46 -39.86 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.078 1.351 . . . . 0.0 112.149 -178.624 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -62.69 172.77 1.5 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.846 1.658 . . . . 0.0 112.72 169.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -142.9 149.24 38.21 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.212 1.805 . . . . 0.0 110.218 171.91 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 72.3 mt -133.52 140.8 45.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 125.726 1.61 . . . . 0.0 109.254 -179.011 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -145.31 166.16 26.34 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.388 1.875 . . . . 0.0 110.186 173.098 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 30.2 p -71.16 163.52 27.46 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.454 -1.404 . . . . 0.0 112.226 173.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -54.43 -41.14 69.04 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.534 -0.729 . . . . 0.0 112.117 169.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.23 -39.18 89.36 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.873 0.869 . . . . 0.0 113.264 177.229 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -65.13 -34.09 77.57 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.277 -0.889 . . . . 0.0 112.831 174.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 81.2 t80 . . . . . 0 CA--C 1.542 0.648 0 C-N-CA 123.393 0.677 . . . . 0.0 112.238 171.457 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.49 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 16.8 m -56.35 -16.84 6.27 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.397 1.479 . . . . 0.0 114.598 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 23.5 p -57.71 -24.15 55.4 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.565 1.946 . . . . 0.0 114.654 169.242 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 150.58 3.15 0.24 Allowed Glycine 0 CA--C 1.539 1.54 0 N-CA-C 117.458 1.743 . . . . 0.0 117.458 170.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 23.6 t -155.92 149.91 25.35 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 120.081 1.94 . . . . 0.0 113.095 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 78.1 p -119.98 -0.35 10.62 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.435 1.894 . . . . 0.0 113.626 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 108.76 -29.5 9.79 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 125.892 1.711 . . . . 0.0 114.191 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 164.74 175.07 35.16 Favored Glycine 0 CA--C 1.54 1.656 0 C-N-CA 124.695 1.141 . . . . 0.0 114.197 177.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -77.32 -9.98 17.59 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 124.29 3.326 . . . . 0.0 114.031 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -65.36 169.38 5.92 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.819 1.648 . . . . 0.0 114.2 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 90.8 mt -123.78 25.4 8.08 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.605 1.562 . . . . 0.0 112.802 -169.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -60.49 158.38 30.32 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 124.528 1.131 . . . . 0.0 112.766 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -51.4 157.15 5.02 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 124.222 3.281 . . . . 0.0 115.38 175.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -131.33 20.02 4.81 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.016 1.726 . . . . 0.0 113.813 -176.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -130.42 16.29 5.47 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 127.204 2.202 . . . . 0.0 112.755 -174.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.44 -19.04 63.09 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.575 1.15 . . . . 0.0 113.906 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -96.98 12.35 32.77 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.143 2.177 . . . . 0.0 113.528 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 45.2 t -120.55 142.56 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.248 1.419 . . . . 0.0 110.995 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 96.3 mt -113.35 163.48 14.8 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 127.201 2.201 . . . . 0.0 111.352 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -123.0 138.71 54.62 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 127.043 2.137 . . . . 0.0 107.433 167.541 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 8.1 t -133.03 137.74 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.794 1.237 . . . . 0.0 109.017 -169.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 15.8 m -127.35 135.52 50.63 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.816 1.246 . . . . 0.0 109.754 -178.036 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -158.08 158.61 30.12 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.772 1.229 . . . . 0.0 112.303 -169.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.42 148.12 34.87 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.844 3.029 . . . . 0.0 113.17 168.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -58.87 -16.16 16.07 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.737 1.755 . . . . 0.0 115.737 -176.798 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -82.36 -14.71 54.84 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.31 1.444 . . . . 0.0 113.948 177.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -62.62 148.72 45.41 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.129 0.877 . . . . 0.0 112.134 173.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -129.69 165.91 20.9 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.962 1.705 . . . . 0.0 111.781 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 m -50.51 -36.06 32.29 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.765 1.226 . . . . 0.0 112.42 172.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.1 m -65.89 -41.54 91.39 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 175.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -64.82 -31.61 72.92 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.737 -0.602 . . . . 0.0 111.18 173.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.62 -46.29 54.83 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.103 0.961 . . . . 0.0 111.573 177.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -58.55 -38.33 77.59 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.23 -0.919 . . . . 0.0 112.48 169.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -67.2 -39.74 86.38 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.908 0.776 . . . . 0.0 112.879 175.48 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 41.7 tp -65.54 -44.16 87.72 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.792 1.237 . . . . 0.0 111.687 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -95.36 6.9 47.79 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -175.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 8.7 t -55.18 -26.67 40.52 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.181 1.393 . . . . 0.0 113.413 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -61.06 -10.56 6.29 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.689 1.595 . . . . 0.0 114.973 174.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -122.68 8.03 9.46 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.501 1.52 . . . . 0.0 113.543 -174.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 80.8 -145.8 26.38 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 121.239 -0.913 . . . . 0.0 113.213 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -63.31 144.03 57.3 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.076 0.95 . . . . 0.0 112.401 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.9 pt -144.95 175.72 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 126.335 1.854 . . . . 0.0 111.491 -175.017 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -136.16 150.35 49.01 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.47 1.508 . . . . 0.0 109.392 168.443 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 69.0 mt -133.58 133.49 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.208 1.403 . . . . 0.0 109.227 -171.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 42.7 m -136.13 100.51 4.43 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.658 1.583 . . . . 0.0 111.196 -177.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -59.8 151.06 26.42 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 32.1 pt -135.09 -20.12 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 124.837 1.255 . . . . 0.0 113.622 169.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -152.37 -179.12 7.27 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.66 1.184 . . . . 0.0 112.104 175.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.33 -25.66 68.14 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.888 1.275 . . . . 0.0 112.719 170.094 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.7 p -125.29 4.13 7.78 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.949 1.699 . . . . 0.0 114.026 -169.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 93.4 p -154.58 156.16 36.05 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 172.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.84 160.18 42.1 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.954 1.702 . . . . 0.0 111.459 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -90.86 150.99 21.32 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.525 0.73 . . . . 0.0 110.108 167.726 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 68.6 t -138.66 126.6 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 124.855 1.262 . . . . 0.0 109.896 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 9.4 t -95.28 137.38 34.41 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.504 1.122 . . . . 0.0 111.253 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 71.9 mt -122.54 158.75 29.2 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.066 1.747 . . . . 0.0 110.177 177.118 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 99.0 p -80.67 -9.85 59.77 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -171.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -145.74 151.09 45.27 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.109 1.364 . . . . 0.0 111.915 177.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -71.57 -19.52 28.09 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.209 2.606 . . . . 0.0 113.308 172.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -65.13 -40.3 94.25 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.683 -1.261 . . . . 0.0 111.677 170.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -64.93 -39.04 92.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.734 0.814 . . . . 0.0 111.401 175.378 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 23.1 t -56.84 -50.71 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.368 1.067 . . . . 0.0 111.173 170.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -60.48 -41.69 94.73 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.391 0.541 . . . . 0.0 112.311 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 81.1 mt -62.62 -47.11 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.862 0.865 . . . . 0.0 111.28 175.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.55 -40.71 97.68 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 119.232 0.923 . . . . 0.0 112.874 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 77.9 t -66.97 -34.01 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.184 0.994 . . . . 0.0 112.172 175.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -70.28 -46.43 64.37 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.114 -0.991 . . . . 0.0 112.221 173.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 24.0 p -73.81 -25.22 59.99 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -174.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 53.7 p -66.4 -19.71 65.87 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -57.39 -22.38 42.46 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.813 1.245 . . . . 0.0 113.746 174.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -98.5 -5.62 31.88 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.198 1.399 . . . . 0.0 113.42 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -77.17 145.5 37.64 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.482 1.113 . . . . 0.0 112.562 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -129.76 0.46 4.87 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.908 1.283 . . . . 0.0 114.286 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 46.6 m -126.61 0.86 6.84 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.809 1.644 . . . . 0.0 112.986 177.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -161.22 171.63 18.1 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.524 2.33 . . . . 0.0 109.741 175.71 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 18.3 tpp85 -148.64 155.13 40.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.855 1.262 . . . . 0.0 111.127 169.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 73.9 mt -134.66 141.59 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.052 1.741 . . . . 0.0 109.387 -173.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -145.96 168.68 20.28 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.259 1.824 . . . . 0.0 110.557 172.237 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 30.4 p -71.62 163.03 28.52 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 120.662 -1.274 . . . . 0.0 112.347 173.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -57.21 -40.8 78.18 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.263 -0.898 . . . . 0.0 111.733 169.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.73 85.12 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.763 0.825 . . . . 0.0 113.03 177.704 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.38 -42.31 96.21 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.235 -0.916 . . . . 0.0 112.212 171.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -59.18 -46.55 88.12 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.03 0.832 . . . . 0.0 111.989 174.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 34.7 t -58.78 -44.75 90.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.546 1.138 . . . . 0.0 112.033 173.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -70.87 -9.07 65.37 Favored Glycine 0 CA--C 1.539 1.579 0 C-N-CA 124.372 0.987 . . . . 0.0 115.007 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -117.69 8.5 12.8 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 127.113 2.165 . . . . 0.0 112.829 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -53.58 -27.78 28.36 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.703 2.001 . . . . 0.0 114.23 -177.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 8.0 pm0 -70.62 47.38 0.1 Allowed 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 127.49 2.316 . . . . 0.0 113.169 169.009 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -48.96 -38.45 23.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 127.582 2.353 . . . . 0.0 115.935 -168.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 53.8 41.26 66.29 Favored Glycine 0 CA--C 1.538 1.514 0 C-N-CA 124.468 1.032 . . . . 0.0 114.144 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -49.69 -40.33 39.85 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 126.568 1.947 . . . . 0.0 115.148 -169.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -140.14 157.48 45.56 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.105 1.362 . . . . 0.0 111.735 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 6.7 p -131.76 1.55 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.027 1.331 . . . . 0.0 113.948 -169.56 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -56.9 -35.47 69.01 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.649 1.18 . . . . 0.0 112.91 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 69.4 m -145.05 -39.62 0.25 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.535 1.934 . . . . 0.0 111.227 169.616 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 156.02 175.92 27.56 Favored Glycine 0 CA--C 1.538 1.514 0 C-N-CA 125.793 1.663 . . . . 0.0 112.685 173.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.8 -20.29 58.76 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.435 2.756 . . . . 0.0 113.198 176.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 19.8 m -66.9 -8.94 32.87 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.423 1.489 . . . . 0.0 114.261 170.282 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 19.6 m -132.6 8.59 4.22 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.762 1.625 . . . . 0.0 113.515 -171.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 C-N-CA 125.323 1.44 . . . . 0.0 112.713 -178.625 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.914 0 C5'-C4'-O4' 112.767 2.548 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.491 0 N-CA-C 111.76 -0.536 . . . . 0.0 111.76 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 17.3 t -152.95 162.43 41.33 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.228 1.411 . . . . 0.0 111.725 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 28.7 m -69.19 -10.0 55.63 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.538 1.535 . . . . 0.0 114.575 178.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -170.18 -176.8 40.0 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.004 1.287 . . . . 0.0 113.797 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 79.2 p -136.99 10.08 3.05 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.407 1.483 . . . . 0.0 114.245 -173.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 8.5 t -149.32 173.06 13.92 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.032 1.733 . . . . 0.0 111.079 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -169.01 178.51 42.24 Favored Glycine 0 CA--C 1.535 1.292 0 C-N-CA 124.134 0.873 . . . . 0.0 114.937 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 171.64 -165.75 38.67 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 125.692 1.615 . . . . 0.0 112.115 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -72.06 -15.13 29.15 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.959 2.44 . . . . 0.0 113.703 175.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -79.62 -2.56 43.16 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 -171.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.1 9.73 26.17 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.303 1.441 . . . . 0.0 114.461 -176.65 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -58.72 148.07 68.98 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 124.101 0.961 . . . . 0.0 112.356 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -77.21 -7.33 17.08 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.653 2.902 . . . . 0.0 114.59 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -58.99 152.09 20.55 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.9 mmt-85 -138.8 11.77 2.68 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.895 2.078 . . . . 0.0 112.927 176.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -58.74 -19.54 41.23 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.161 1.384 . . . . 0.0 113.731 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -115.34 16.61 16.76 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.588 2.355 . . . . 0.0 112.904 -175.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 42.9 t -123.1 138.47 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.677 1.191 . . . . 0.0 112.165 -170.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 76.8 mt -118.22 164.3 15.38 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 127.191 2.196 . . . . 0.0 110.839 175.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -118.09 141.96 47.92 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.802 2.041 . . . . 0.0 107.908 167.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.7 t -133.16 139.25 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.556 1.542 . . . . 0.0 109.107 -171.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.5 m -128.14 134.87 49.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.346 1.458 . . . . 0.0 109.594 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -158.32 158.58 29.85 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.715 1.206 . . . . 0.0 111.539 -170.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -66.17 151.16 84.31 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.061 1.841 . . . . 0.0 111.065 169.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -60.65 -11.72 8.14 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -66.68 -19.81 65.84 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.47 1.108 . . . . 0.0 113.522 171.297 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -73.61 153.31 40.24 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.285 1.034 . . . . 0.0 112.758 175.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 173.46 11.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.6 1.96 . . . . 0.0 111.691 175.456 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 m -49.12 -35.77 17.25 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.197 1.399 . . . . 0.0 112.395 171.538 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.7 m -64.5 -43.31 94.51 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 176.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -65.92 -31.61 72.64 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.653 -0.654 . . . . 0.0 111.187 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.0 mt -71.44 -43.7 66.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.868 0.867 . . . . 0.0 111.502 175.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -58.68 -42.43 88.51 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.943 -1.098 . . . . 0.0 111.753 169.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -62.81 -33.82 76.02 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 119.035 0.834 . . . . 0.0 112.971 176.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.2 tp -73.37 -29.93 62.95 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.789 1.236 . . . . 0.0 113.369 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -121.06 -0.2 10.06 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -169.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 78.0 p -56.88 -23.91 48.03 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 176.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -57.71 -17.07 13.03 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.469 1.508 . . . . 0.0 114.545 174.378 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -99.56 3.71 45.54 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.218 1.407 . . . . 0.0 113.99 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.67 -44.1 3.04 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.955 1.741 . . . . 0.0 115.817 168.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -150.16 133.84 16.7 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.878 1.271 . . . . 0.0 110.594 177.481 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.9 pt -146.1 173.25 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.018 1.327 . . . . 0.0 112.101 -172.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 62.8 tp60 -139.92 139.1 36.1 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.002 1.321 . . . . 0.0 108.817 167.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 71.8 mt -112.94 132.36 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.11 1.364 . . . . 0.0 108.279 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 57.9 m -141.03 95.97 2.93 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.258 1.423 . . . . 0.0 111.095 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -57.97 152.68 15.81 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -177.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 37.7 pt -134.26 -19.8 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 125.21 1.404 . . . . 0.0 113.398 169.185 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -153.64 178.27 10.04 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.733 1.213 . . . . 0.0 111.994 174.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -63.61 -17.42 62.86 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.36 1.864 . . . . 0.0 112.733 171.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.2 p -135.07 7.59 3.42 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 127.197 2.199 . . . . 0.0 113.64 -171.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 4.0 m -149.66 146.37 27.23 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.21 1.004 . . . . 0.0 113.693 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.44 158.98 43.4 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.189 1.395 . . . . 0.0 112.04 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -90.38 152.75 20.86 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.75 0.82 . . . . 0.0 109.726 167.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.0 t -136.11 115.05 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 C-N-CA 124.231 1.012 . . . . 0.0 110.42 173.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 24.0 m -79.21 143.36 35.42 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.248 1.419 . . . . 0.0 109.831 169.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 76.7 mt -119.7 161.6 20.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.938 1.295 . . . . 0.0 111.092 175.838 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 21.1 t -60.32 -34.84 74.39 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.627 1.171 . . . . 0.0 113.673 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -140.32 151.53 64.55 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 125.179 1.392 . . . . 0.0 111.684 -177.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -69.21 -23.71 32.99 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.129 2.553 . . . . 0.0 113.868 -178.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.72 -33.64 75.53 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 120.863 -1.148 . . . . 0.0 112.387 173.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -66.1 -27.71 68.26 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.284 1.033 . . . . 0.0 112.785 -179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 90.0 t -61.93 -46.56 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.776 1.23 . . . . 0.0 110.617 173.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -63.53 -41.25 98.48 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.642 0.777 . . . . 0.0 111.699 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.32 -51.32 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.652 0.781 . . . . 0.0 110.528 175.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.89 90.88 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.8 t -62.77 -36.72 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 O-C-N 121.025 -1.047 . . . . 0.0 111.754 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -73.11 -30.57 63.74 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -91.48 -33.06 15.35 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -176.604 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 90.0 p -70.08 -17.75 63.24 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 50.7 pttt -59.93 -12.07 7.0 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.162 1.541 . . . . 0.0 115.162 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -101.01 1.31 39.44 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.898 1.679 . . . . 0.0 113.968 178.023 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -61.85 159.26 14.2 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.63 1.172 . . . . 0.0 113.958 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.82 -1.93 2.18 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.033 1.333 . . . . 0.0 114.57 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 78.2 p -140.81 1.48 1.69 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.446 1.498 . . . . 0.0 114.172 -176.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -156.75 175.43 14.07 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.038 2.135 . . . . 0.0 109.983 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 76.6 ttt-85 -145.85 150.89 36.98 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.351 1.46 . . . . 0.0 110.895 172.479 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 85.0 mt -131.88 144.93 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 126.18 1.792 . . . . 0.0 109.577 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -150.27 169.27 21.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.735 1.614 . . . . 0.0 110.747 169.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 59.9 p -71.06 162.63 29.1 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 120.815 -1.178 . . . . 0.0 112.229 174.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -58.13 -37.57 74.86 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 121.386 -0.821 . . . . 0.0 112.085 169.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.71 -38.39 89.05 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.76 0.824 . . . . 0.0 113.0 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -67.66 -39.18 84.56 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.117 -0.989 . . . . 0.0 112.545 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -57.95 -47.04 84.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.775 0.83 . . . . 0.0 111.737 172.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 27.2 t -58.97 -43.43 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.639 1.176 . . . . 0.0 112.172 171.497 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -63.82 -25.4 69.11 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 124.643 1.115 . . . . 0.0 115.298 -172.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -81.72 -45.21 16.0 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.9 1.35 . . . . 0.0 111.808 168.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -60.21 -31.08 69.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.409 1.484 . . . . 0.0 114.793 -172.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -59.71 -18.77 45.26 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 175.589 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -100.11 -13.8 18.83 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.522 1.529 . . . . 0.0 113.235 176.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -84.46 52.71 4.74 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 126.077 1.799 . . . . 0.0 114.238 -175.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -140.81 154.09 46.09 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.613 1.565 . . . . 0.0 111.937 -174.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -144.83 174.14 11.25 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.94 1.696 . . . . 0.0 112.002 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.8 m -127.44 18.04 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 125.461 1.504 . . . . 0.0 113.2 -172.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -141.86 169.89 16.75 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.317 1.847 . . . . 0.0 112.391 -178.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 8.0 t -144.92 -177.59 5.6 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.607 1.563 . . . . 0.0 112.028 -176.137 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -126.72 67.67 0.54 Allowed Glycine 0 CA--C 1.537 1.447 0 C-N-CA 126.54 2.019 . . . . 0.0 112.906 -175.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -67.14 -10.92 30.29 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.905 3.07 . . . . 0.0 114.569 -175.67 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 45.6 p -68.3 -20.24 64.75 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.204 1.402 . . . . 0.0 114.248 172.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 71.5 m -65.89 153.42 42.06 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.494 1.117 . . . . 0.0 112.987 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.268 0 C-N-CA 125.152 1.358 . . . . 0.0 112.825 178.251 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.766 0 C5'-C4'-O4' 113.112 2.794 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.538 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 23.3 m 52.3 29.08 6.29 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 125.558 1.543 . . . . 0.0 114.035 -173.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.7 m -62.83 -20.78 65.39 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.068 1.747 . . . . 0.0 115.381 -169.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -68.94 -27.25 74.06 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 124.066 0.841 . . . . 0.0 114.218 177.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 49.0 m -66.42 -21.53 66.21 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 43.0 m -64.59 -12.81 49.23 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -131.51 8.74 5.58 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.776 1.179 . . . . 0.0 115.269 -178.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 39.21 54.54 2.55 Favored Glycine 0 CA--C 1.546 1.995 0 C-N-CA 126.249 1.88 . . . . 0.0 116.817 178.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -66.68 166.49 22.03 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.597 2.865 . . . . 0.0 113.171 -177.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -140.7 174.7 10.26 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.889 1.276 . . . . 0.0 113.761 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.09 4.63 33.23 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 -171.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -58.46 131.44 85.05 Favored Pre-proline 0 CA--C 1.55 0.973 0 CA-C-N 119.484 1.038 . . . . 0.0 112.188 -175.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -78.47 -7.12 15.82 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.662 2.908 . . . . 0.0 114.306 -176.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -138.36 156.68 47.38 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.191 1.796 . . . . 0.0 111.271 -174.787 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -135.99 8.82 3.26 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 126.053 1.741 . . . . 0.0 113.1 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -63.53 -23.85 67.56 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.569 1.147 . . . . 0.0 113.442 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -93.71 17.57 11.65 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 127.502 2.321 . . . . 0.0 113.584 176.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 24.6 t -126.52 135.88 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.813 1.245 . . . . 0.0 111.399 -170.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 89.7 mt -103.11 167.0 10.11 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.693 1.997 . . . . 0.0 111.8 174.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -122.95 135.69 54.58 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 127.376 2.27 . . . . 0.0 107.224 167.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.4 t -131.35 140.16 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.797 1.239 . . . . 0.0 109.084 -171.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 9.9 m -131.18 136.62 48.45 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.041 1.336 . . . . 0.0 109.76 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -158.91 158.74 29.34 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.477 1.111 . . . . 0.0 112.415 -169.708 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -53.79 148.72 35.89 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.79 2.993 . . . . 0.0 113.281 169.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -61.11 -9.33 4.44 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -85.02 -12.23 53.62 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.333 1.453 . . . . 0.0 113.931 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 7.9 m95 -63.61 157.7 23.17 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -131.52 162.93 29.11 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.577 1.951 . . . . 0.0 111.651 -178.369 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.6 m -52.74 -35.95 56.96 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.763 1.225 . . . . 0.0 111.999 169.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.2 m -66.37 -41.52 89.34 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.496 0.925 . . . . 0.0 113.496 176.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -65.28 -30.68 71.57 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.792 -0.567 . . . . 0.0 111.393 173.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 62.0 mt -70.71 -47.31 60.45 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.867 0.867 . . . . 0.0 111.479 175.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -58.41 -38.93 78.4 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.99 -1.069 . . . . 0.0 112.452 170.441 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -65.91 -39.34 90.5 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.072 0.851 . . . . 0.0 112.844 175.438 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.38 -33.84 75.53 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.243 1.417 . . . . 0.0 112.11 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -110.85 9.8 22.47 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.711 1.374 . . . . 0.0 114.711 -174.385 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 32.8 m -57.97 -22.06 47.38 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 121.03 -1.044 . . . . 0.0 113.771 173.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.08 -15.23 12.8 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.435 1.494 . . . . 0.0 114.685 171.218 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -113.33 4.01 16.19 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.587 1.555 . . . . 0.0 113.627 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.68 -44.95 2.82 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 126.0 1.762 . . . . 0.0 115.242 172.536 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -153.3 144.38 22.97 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.826 1.25 . . . . 0.0 111.894 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 15.4 pt -145.35 176.03 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 126.349 1.86 . . . . 0.0 111.611 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -136.85 145.23 44.17 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.944 1.298 . . . . 0.0 109.415 168.102 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 76.2 mt -123.51 134.51 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.438 1.095 . . . . 0.0 110.051 -169.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.4 m -134.33 96.89 3.69 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 126.216 1.806 . . . . 0.0 109.966 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -55.83 155.8 5.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.475 1.11 . . . . 0.0 113.88 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 12.7 mt -128.49 -39.07 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.967 1.307 . . . . 0.0 109.959 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -153.67 -172.4 4.22 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.71 1.604 . . . . 0.0 110.52 174.27 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -63.93 -17.75 63.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.687 1.195 . . . . 0.0 113.073 172.254 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.9 p -127.41 2.87 6.28 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 126.433 1.893 . . . . 0.0 114.332 -169.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 80.1 p -153.73 153.92 33.11 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.94 151.73 31.6 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.45 1.5 . . . . 0.0 111.86 -179.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -89.59 145.87 24.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.936 0.894 . . . . 0.0 108.86 167.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.4 t -137.88 111.26 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.86 0.864 . . . . 0.0 110.984 -176.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 66.5 m -75.87 138.31 41.0 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.917 1.687 . . . . 0.0 110.955 171.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 49.5 mt -112.61 163.39 14.58 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.303 1.041 . . . . 0.0 112.199 178.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 17.6 t -64.37 -34.04 77.25 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.252 1.021 . . . . 0.0 113.318 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -141.11 149.49 55.69 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.333 1.453 . . . . 0.0 111.21 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.44 -24.65 26.32 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.95 2.433 . . . . 0.0 113.991 -177.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.52 -27.03 68.17 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.754 -1.216 . . . . 0.0 113.39 174.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -67.43 -26.14 66.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.434 1.094 . . . . 0.0 112.272 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.5 t -61.78 -45.38 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.936 1.294 . . . . 0.0 110.257 176.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.25 -39.63 92.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.79 0.836 . . . . 0.0 111.825 177.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 99.3 mt -60.96 -49.67 83.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 123.91 0.884 . . . . 0.0 110.573 175.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.15 93.42 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 74.8 t -63.66 -40.62 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.427 -0.795 . . . . 0.0 110.961 173.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -64.05 -45.13 90.17 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.889 0.768 . . . . 0.0 112.836 175.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -72.9 -27.5 61.92 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -176.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 31.7 p -62.77 -19.76 64.31 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -60.07 -12.6 8.64 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.245 1.418 . . . . 0.0 114.011 171.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -121.0 12.09 11.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.009 1.723 . . . . 0.0 112.699 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.72 164.37 10.0 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.661 1.185 . . . . 0.0 113.061 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -132.98 -13.37 2.81 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.141 1.376 . . . . 0.0 113.085 178.179 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 71.1 p -145.84 7.71 1.09 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.114 1.365 . . . . 0.0 114.682 -170.448 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -157.72 175.06 14.39 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.978 1.711 . . . . 0.0 111.418 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 -146.4 149.66 34.18 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.219 1.808 . . . . 0.0 110.507 172.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 88.0 mt -133.87 145.67 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.853 1.661 . . . . 0.0 109.605 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.2 pt20 -149.73 170.43 18.74 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.128 1.771 . . . . 0.0 110.36 169.615 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 25.4 p -72.08 164.51 26.03 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.536 -1.352 . . . . 0.0 112.191 173.028 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -55.34 -41.79 72.96 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.273 -0.892 . . . . 0.0 111.934 169.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -69.38 -38.13 77.89 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.859 0.864 . . . . 0.0 113.213 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -61.44 -41.31 97.0 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.841 0.856 . . . . 0.0 111.962 173.649 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -61.0 -52.19 66.06 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.383 0.538 . . . . 0.0 111.843 172.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 25.0 t -54.81 -44.15 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 124.216 1.007 . . . . 0.0 112.312 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -69.94 -9.14 62.46 Favored Glycine 0 CA--C 1.54 1.611 0 C-N-CA 124.348 0.975 . . . . 0.0 115.243 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -114.52 -12.69 12.26 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.241 1.816 . . . . 0.0 113.055 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -58.53 -39.38 79.99 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.52 1.928 . . . . 0.0 113.692 -175.435 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -145.98 -48.81 0.21 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.85 1.26 . . . . 0.0 112.958 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -157.05 169.54 24.58 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.005 1.322 . . . . 0.0 113.004 -172.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -168.16 177.46 42.29 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.466 1.508 . . . . 0.0 113.237 176.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -66.36 167.14 11.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.289 1.436 . . . . 0.0 113.239 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -134.26 155.35 50.33 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.864 1.666 . . . . 0.0 111.346 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.9 m -73.32 -16.89 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 -173.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -150.62 149.73 30.24 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.352 1.461 . . . . 0.0 111.589 -176.456 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 70.9 m -142.15 166.13 25.55 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.642 1.977 . . . . 0.0 111.007 175.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -175.49 171.92 44.98 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 124.431 1.015 . . . . 0.0 113.697 176.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -75.65 -20.67 15.39 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.701 2.934 . . . . 0.0 114.0 -176.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 86.6 p -157.25 169.36 24.94 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.638 1.575 . . . . 0.0 112.103 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 43.3 m -132.98 9.3 4.14 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.203 1.401 . . . . 0.0 113.826 -177.414 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.186 0 C-N-CA 125.382 1.467 . . . . 0.0 112.714 -178.748 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 O5'-C5'-C4' 113.77 2.55 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.534 0 N-CA-C 111.716 -0.554 . . . . 0.0 111.716 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 22.6 m -132.85 8.36 4.12 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 17.9 t -60.01 -31.92 70.39 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.644 1.177 . . . . 0.0 113.249 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -64.22 -10.51 41.64 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 124.971 1.272 . . . . 0.0 115.133 172.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 45.7 m -129.22 19.1 5.91 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.843 2.057 . . . . 0.0 111.799 177.433 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 25.5 m 52.25 21.21 1.57 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.885 2.074 . . . . 0.0 115.291 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 69.06 2.24 30.38 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 125.037 1.303 . . . . 0.0 115.698 -174.158 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 154.82 177.84 28.54 Favored Glycine 0 CA--C 1.542 1.752 0 CA-C-N 119.09 1.445 . . . . 0.0 114.152 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.38 173.76 11.05 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 124.143 3.228 . . . . 0.0 113.107 177.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -70.98 1.78 5.21 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.974 1.709 . . . . 0.0 115.59 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.7 pp -143.68 176.49 9.18 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.379 1.872 . . . . 0.0 112.21 -178.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 25.2 pt20 -147.71 140.22 14.54 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 124.536 1.134 . . . . 0.0 111.684 177.353 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -59.64 -34.38 96.48 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 123.539 2.826 . . . . 0.0 116.139 -176.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -141.35 173.09 11.82 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.101 1.76 . . . . 0.0 112.321 -169.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -130.35 14.48 5.57 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 126.813 2.045 . . . . 0.0 113.377 -174.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -60.34 -14.21 17.24 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.395 1.478 . . . . 0.0 114.524 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 46.3 p-80 -117.3 18.05 14.54 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 128.154 2.582 . . . . 0.0 112.44 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 26.6 t -123.92 143.75 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.239 1.416 . . . . 0.0 111.267 -174.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 70.8 mt -121.88 166.54 14.25 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.462 2.305 . . . . 0.0 110.672 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -125.21 142.82 51.27 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 126.641 1.977 . . . . 0.0 108.395 168.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -135.64 142.46 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.836 1.254 . . . . 0.0 109.558 -169.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 2.0 m -129.65 137.4 50.64 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.119 1.368 . . . . 0.0 109.796 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -159.36 157.3 27.01 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 124.413 1.085 . . . . 0.0 112.371 -169.155 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.52 143.85 65.65 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.721 2.947 . . . . 0.0 112.75 169.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -55.61 -25.38 38.38 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.073 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -65.95 -13.41 59.72 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.562 1.545 . . . . 0.0 114.356 177.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -69.14 156.37 38.8 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.321 1.048 . . . . 0.0 112.784 172.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -128.99 171.17 12.61 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.538 1.935 . . . . 0.0 110.969 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.0 m -52.41 -32.55 39.58 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.025 1.33 . . . . 0.0 111.757 169.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.3 m -64.46 -43.23 94.88 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 173.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -66.48 -30.99 71.44 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.572 -0.705 . . . . 0.0 111.277 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 74.9 mt -70.15 -43.77 70.19 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.639 0.776 . . . . 0.0 111.408 173.813 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -58.5 -39.91 81.35 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 120.854 -1.154 . . . . 0.0 112.196 169.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -65.83 -34.51 78.31 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 119.126 0.875 . . . . 0.0 113.038 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 58.3 tp -70.64 -31.03 67.83 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.595 1.158 . . . . 0.0 113.056 176.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -117.22 6.03 12.74 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -171.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 78.2 p -57.67 -25.29 60.02 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 178.004 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.16 -15.65 15.82 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.549 1.54 . . . . 0.0 114.662 176.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -101.8 3.07 39.04 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.108 1.363 . . . . 0.0 114.069 -176.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.89 -48.72 4.1 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.906 1.717 . . . . 0.0 114.998 169.48 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -152.13 140.18 20.2 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.805 1.242 . . . . 0.0 111.113 176.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 30.5 pt -146.0 174.94 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.925 1.69 . . . . 0.0 111.842 -171.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 8.0 tm0? -139.91 139.54 36.22 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.978 1.311 . . . . 0.0 108.612 169.153 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 72.5 mt -120.84 130.07 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.879 1.272 . . . . 0.0 109.448 -175.029 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.3 m -134.78 99.61 4.37 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.335 1.454 . . . . 0.0 111.335 -176.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -57.4 152.26 14.74 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.768 1.227 . . . . 0.0 113.666 175.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 19.6 pt -134.15 -25.86 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.77 1.228 . . . . 0.0 113.173 169.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -156.0 179.32 9.33 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.048 1.339 . . . . 0.0 112.114 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.88 -14.09 60.84 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 -175.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 50.1 p -132.46 6.44 4.11 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.295 1.438 . . . . 0.0 113.603 -177.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 1.1 p -150.92 152.15 33.2 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 173.17 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -155.34 159.45 39.95 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.372 1.469 . . . . 0.0 111.87 -174.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.87 152.48 21.23 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.426 0.69 . . . . 0.0 110.769 168.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 59.6 t -137.21 116.25 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.954 1.301 . . . . 0.0 109.748 174.645 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 8.4 t -85.08 140.85 30.67 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.961 1.304 . . . . 0.0 110.53 172.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 60.9 mt -117.77 165.05 14.1 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.235 1.414 . . . . 0.0 111.548 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 9.4 t -62.97 -32.38 73.7 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.399 1.08 . . . . 0.0 113.864 -173.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -152.67 157.34 33.44 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.193 0.997 . . . . 0.0 112.919 175.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.13 -33.24 63.1 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.393 3.395 . . . . 0.0 115.517 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -58.21 -35.65 71.96 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -70.0 -23.4 63.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.405 1.082 . . . . 0.0 113.262 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 99.0 t -59.48 -44.22 92.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.155 1.382 . . . . 0.0 111.094 177.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -66.57 -34.95 79.05 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.594 0.758 . . . . 0.0 112.061 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 59.8 mt -64.96 -48.15 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.696 0.798 . . . . 0.0 110.212 176.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.95 -38.51 91.34 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.3 t -63.97 -40.22 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 121.31 -0.869 . . . . 0.0 111.361 173.126 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -61.09 -49.92 75.34 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.03 0.832 . . . . 0.0 112.201 172.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.0 p -67.3 -27.01 66.82 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -174.693 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 9.4 t -64.27 -19.7 65.57 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 171.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -60.78 -18.82 57.42 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.519 1.128 . . . . 0.0 113.147 172.497 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -117.33 7.69 12.92 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.858 1.663 . . . . 0.0 112.762 -175.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.22 156.97 30.14 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.27 1.428 . . . . 0.0 113.392 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -134.23 -12.26 2.47 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.773 1.229 . . . . 0.0 114.058 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 38.3 m -139.13 6.89 2.4 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.08 1.352 . . . . 0.0 113.744 -173.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -158.65 176.01 12.92 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.042 1.737 . . . . 0.0 111.31 -176.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 498' ' ' ARG . . . . . 0.456 HH22 ' NE2' ' A' ' 500' ' ' GLN . 50.1 ttp85 -147.27 145.79 29.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.581 1.952 . . . . 0.0 110.098 174.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 69.5 mt -130.77 141.97 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.738 1.615 . . . . 0.0 109.629 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 500' ' ' GLN . . . . . 0.456 ' NE2' HH22 ' A' ' 498' ' ' ARG . 24.0 pt20 -145.1 166.59 24.96 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.825 1.65 . . . . 0.0 110.924 171.124 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 52.0 p -71.72 163.24 28.15 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 120.756 -1.215 . . . . 0.0 112.378 174.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -58.69 -37.01 75.13 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.187 -0.946 . . . . 0.0 112.063 170.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.71 95.95 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.333 -0.854 . . . . 0.0 112.809 174.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -65.35 -32.68 74.45 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.348 -0.845 . . . . 0.0 112.977 173.375 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -66.46 -50.85 61.93 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.119 0.872 . . . . 0.0 111.427 169.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 16.4 t -53.49 -44.08 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.727 1.211 . . . . 0.0 112.046 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -67.87 -5.86 41.46 Favored Glycine 0 CA--C 1.539 1.592 0 C-N-CA 124.819 1.199 . . . . 0.0 115.596 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -115.23 -31.07 6.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.797 1.639 . . . . 0.0 112.314 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -60.2 -33.65 72.53 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.463 1.905 . . . . 0.0 112.639 169.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -134.35 133.31 40.5 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.628 1.571 . . . . 0.0 110.104 173.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -136.99 19.71 3.01 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 125.888 1.675 . . . . 0.0 113.044 -173.516 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -165.75 175.46 41.4 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.175 1.369 . . . . 0.0 113.607 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -146.63 -35.2 0.27 Allowed 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -173.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 37.7 tp60 -77.41 29.66 0.15 Allowed 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.549 1.539 . . . . 0.0 114.151 -174.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 34.4 m -64.43 -20.45 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 O-C-N 120.395 -1.44 . . . . 0.0 114.241 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 516' ' ' LYS . . . . . 0.404 ' HA ' ' HE2' ' A' ' 516' ' ' LYS . 0.4 OUTLIER -149.32 94.19 2.18 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.021 1.728 . . . . 0.0 110.394 177.468 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 65.1 m -62.32 161.61 11.21 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.26 1.024 . . . . 0.0 112.814 173.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -178.77 -167.16 36.0 Favored Glycine 0 CA--C 1.54 1.595 0 C-N-CA 124.977 1.275 . . . . 0.0 112.624 -176.919 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.39 -19.42 68.08 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 123.343 2.695 . . . . 0.0 113.405 178.495 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 34.6 p -64.81 -8.98 17.26 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.884 1.674 . . . . 0.0 114.387 169.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 19.3 m -126.13 9.51 7.4 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.303 1.841 . . . . 0.0 113.271 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.25 0 CA-C-O 118.288 -1.284 . . . . 0.0 113.135 -179.281 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.363 0 O5'-C5'-C4' 113.656 2.469 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 23.2 t -153.55 -40.17 0.1 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.474 1.11 . . . . 0.0 113.013 177.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 84.3 p -152.11 167.42 28.56 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.369 1.467 . . . . 0.0 112.196 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -167.33 24.26 0.12 Allowed Glycine 0 CA--C 1.537 1.449 0 N-CA-C 115.354 0.902 . . . . 0.0 115.354 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 36.9 t -154.95 152.21 29.44 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.098 1.359 . . . . 0.0 111.599 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 59.8 p -71.59 -22.57 61.71 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.901 1.28 . . . . 0.0 113.345 169.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 73.92 2.79 62.36 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 125.194 1.378 . . . . 0.0 115.522 -178.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 152.1 -168.37 31.32 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 125.164 1.364 . . . . 0.0 112.838 -175.655 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -64.78 -24.06 62.06 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 122.948 2.432 . . . . 0.0 112.532 169.663 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -151.04 -169.75 3.47 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.953 2.501 . . . . 0.0 108.861 168.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.3 pp -58.9 -3.94 0.4 Allowed 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 116.963 2.209 . . . . 0.0 116.963 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -131.74 117.42 16.31 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 127.019 2.128 . . . . 0.0 109.517 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.68 12.3 0.93 Allowed 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 124.494 3.463 . . . . 0.0 116.76 -171.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -57.74 -6.14 0.48 Allowed 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 -130.47 14.56 5.51 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.706 1.602 . . . . 0.0 113.874 169.728 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.64 -15.42 63.64 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.649 -1.282 . . . . 0.0 113.578 176.327 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 -88.19 8.0 29.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.401 1.881 . . . . 0.0 114.08 172.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 40.7 t -110.86 148.58 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.092 1.357 . . . . 0.0 110.903 -173.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 94.5 mt -122.69 164.24 18.63 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.186 2.594 . . . . 0.0 110.522 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -126.75 139.12 53.37 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.461 1.905 . . . . 0.0 107.679 168.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.4 t -132.85 141.83 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.975 1.31 . . . . 0.0 109.226 -169.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.6 m -132.88 135.15 45.42 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.881 1.272 . . . . 0.0 109.753 -177.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -159.85 162.55 24.51 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 124.994 1.318 . . . . 0.0 111.719 -168.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.44 149.14 90.55 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.215 1.943 . . . . 0.0 110.909 168.733 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -18.54 13.71 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -57.34 -26.26 60.69 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.052 1.741 . . . . 0.0 113.979 173.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 19.7 m95 -64.65 154.4 36.56 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.001 0.921 . . . . 0.0 113.087 175.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -132.17 164.99 25.1 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.597 1.959 . . . . 0.0 111.129 177.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.9 m -53.29 -34.75 58.61 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.743 1.217 . . . . 0.0 112.156 173.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.2 m -65.36 -43.35 91.11 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.734 1.012 . . . . 0.0 113.734 175.137 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -64.81 -31.64 72.96 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.675 -0.64 . . . . 0.0 111.309 174.35 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.2 mt -71.05 -44.99 64.66 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.031 0.932 . . . . 0.0 111.551 175.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -57.22 -42.54 81.57 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.009 -1.057 . . . . 0.0 112.109 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -68.26 -29.07 67.79 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.458 1.103 . . . . 0.0 113.935 177.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.6 tp -69.5 -36.49 76.52 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.334 1.054 . . . . 0.0 112.316 173.547 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -110.96 -2.61 15.92 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -170.515 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 79.0 p -58.09 -19.66 33.8 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 176.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -57.41 -18.93 20.36 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.084 1.354 . . . . 0.0 114.133 170.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -100.18 2.71 43.2 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.743 1.617 . . . . 0.0 113.612 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 96.27 -159.67 21.97 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.011 1.291 . . . . 0.0 111.891 -171.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -64.24 150.37 46.06 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 121.838 -0.801 . . . . 0.0 111.25 169.203 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 5.5 pt -143.53 179.76 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 125.338 1.455 . . . . 0.0 111.655 -174.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -128.15 151.9 48.66 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.537 1.535 . . . . 0.0 110.699 170.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 60.3 mt -139.4 134.35 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.919 1.688 . . . . 0.0 108.972 -172.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.9 m -139.35 102.2 4.43 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.991 1.316 . . . . 0.0 111.384 -177.45 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -59.28 153.15 19.28 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 29.5 pt -134.9 -23.93 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.831 1.252 . . . . 0.0 113.416 169.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -153.7 174.38 14.59 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.353 1.061 . . . . 0.0 111.947 174.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -60.88 -15.09 26.82 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.601 1.96 . . . . 0.0 113.898 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 37.2 p -135.91 6.24 3.14 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.001 2.12 . . . . 0.0 113.448 -174.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 66.5 m -147.38 140.29 25.0 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.394 1.078 . . . . 0.0 113.218 -174.281 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.45 158.7 42.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.529 1.131 . . . . 0.0 112.49 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -89.04 153.29 21.12 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.753 0.821 . . . . 0.0 110.006 167.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 73.4 t -136.3 140.53 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.92 1.288 . . . . 0.0 109.091 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 43.0 m -124.97 116.09 21.61 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.206 1.403 . . . . 0.0 110.083 -169.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 47.1 mt -102.94 166.32 10.52 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.202 1.401 . . . . 0.0 111.176 -175.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 50.8 m -69.84 -26.75 64.37 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 -175.279 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -148.22 148.85 30.54 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 124.497 1.119 . . . . 0.0 112.348 -177.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -57.18 -26.02 67.37 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 123.5 2.8 . . . . 0.0 114.124 168.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -61.04 -33.54 73.46 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.064 -1.023 . . . . 0.0 112.56 172.25 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -76.46 -34.31 58.7 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.845 0.858 . . . . 0.0 111.799 174.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 22.4 t -57.54 -44.69 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.065 0.946 . . . . 0.0 111.354 170.292 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -58.97 -41.04 86.58 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.133 0.573 . . . . 0.0 112.378 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 91.0 mt -66.87 -45.76 86.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.634 0.773 . . . . 0.0 110.938 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.1 -34.32 76.1 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 119.324 0.965 . . . . 0.0 113.466 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 60.4 t -65.73 -43.84 93.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 O-C-N 121.296 -0.878 . . . . 0.0 111.003 170.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -60.5 -45.06 95.16 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.922 0.783 . . . . 0.0 112.729 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 46.0 p -71.64 -27.4 63.06 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -177.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 24.8 p -63.21 -19.05 64.17 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 59.1 mtmt -60.96 -18.38 56.95 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.254 1.422 . . . . 0.0 113.963 173.452 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -119.06 1.4 11.41 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.064 1.345 . . . . 0.0 113.211 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -68.19 152.78 44.96 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.669 1.188 . . . . 0.0 112.469 173.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -132.27 -4.9 3.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.818 1.247 . . . . 0.0 114.044 -177.564 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 22.6 m -136.52 5.9 2.96 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.322 1.449 . . . . 0.0 113.413 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -161.04 171.52 18.47 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.039 2.135 . . . . 0.0 110.173 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -147.79 156.88 43.2 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.122 1.369 . . . . 0.0 111.06 169.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 69.3 mt -133.49 146.38 32.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.766 1.626 . . . . 0.0 109.572 -174.375 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -142.11 161.78 37.15 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.98 1.712 . . . . 0.0 109.679 168.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 26.3 p -71.89 162.29 29.67 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.702 -1.249 . . . . 0.0 111.888 173.687 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -60.39 -33.41 72.44 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.161 -0.962 . . . . 0.0 111.953 169.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.91 -38.02 89.58 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.299 -0.875 . . . . 0.0 113.111 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -67.78 -39.67 84.07 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.09 -1.006 . . . . 0.0 112.144 172.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -62.23 -40.03 94.79 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.247 1.019 . . . . 0.0 112.288 174.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 12.5 t -64.72 -42.21 94.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 125.279 1.432 . . . . 0.0 112.028 169.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -62.12 -36.73 93.37 Favored Glycine 0 CA--C 1.537 1.432 0 O-C-N 121.008 -1.058 . . . . 0.0 112.504 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -67.07 -35.48 79.92 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.359 1.064 . . . . 0.0 113.197 169.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -56.84 -42.36 79.54 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.474 1.11 . . . . 0.0 112.132 172.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -75.21 -12.24 60.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.16 1.384 . . . . 0.0 114.337 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -136.59 30.51 2.87 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 126.008 1.723 . . . . 0.0 112.639 -171.741 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -173.32 -153.46 9.62 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 125.378 1.466 . . . . 0.0 112.623 -172.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -129.59 133.38 47.14 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.249 1.42 . . . . 0.0 111.375 177.229 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -153.88 6.09 0.32 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.64 1.176 . . . . 0.0 113.236 -170.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.6 m -58.99 -18.95 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -169.201 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -67.52 -15.81 63.86 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.126 1.37 . . . . 0.0 113.831 173.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 49.2 m -130.39 148.77 52.24 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.962 1.305 . . . . 0.0 112.677 -171.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 163.04 -176.59 39.27 Favored Glycine 0 CA--C 1.541 1.706 0 C-N-CA 125.097 1.332 . . . . 0.0 113.147 -178.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -52.6 154.83 11.25 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.205 3.27 . . . . 0.0 114.001 172.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 65.4 p -60.29 -19.36 54.66 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 177.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 21.4 m -65.89 -17.46 64.67 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.504 1.522 . . . . 0.0 114.628 174.634 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.21 0 CA-C-O 118.322 -1.265 . . . . 0.0 113.349 -179.543 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.616 0 C5'-C4'-O4' 113.208 2.863 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.219 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 48.9 m -140.73 -2.4 1.36 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.609 1.563 . . . . 0.0 114.327 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 67.8 m -138.14 170.8 15.4 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.809 1.244 . . . . 0.0 113.119 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 169.2 -22.86 0.1 OUTLIER Glycine 0 CA--C 1.538 1.483 0 N-CA-C 115.458 0.943 . . . . 0.0 115.458 177.881 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 60.1 p -71.88 -10.87 60.39 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 20.3 m -59.77 157.61 11.83 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.674 1.59 . . . . 0.0 113.75 178.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 77.54 -152.72 39.76 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 123.837 0.732 . . . . 0.0 113.55 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -155.83 172.99 33.88 Favored Glycine 0 CA--C 1.541 1.69 0 C-N-CA 124.932 1.254 . . . . 0.0 113.482 178.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -72.04 151.96 56.47 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.716 2.944 . . . . 0.0 113.431 -173.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -155.06 166.94 32.0 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.312 1.845 . . . . 0.0 110.44 173.242 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 91.0 mt -127.16 15.8 7.26 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.152 1.381 . . . . 0.0 114.32 -168.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -134.33 146.26 58.76 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.241 1.017 . . . . 0.0 112.859 -176.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.45 147.97 47.5 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.414 2.743 . . . . 0.0 111.654 173.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -140.41 31.34 1.91 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 125.608 1.563 . . . . 0.0 112.448 -170.783 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.65 112.49 11.47 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.226 1.41 . . . . 0.0 112.398 -174.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -156.13 -43.07 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.816 2.046 . . . . 0.0 109.729 170.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 -70.26 38.19 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.132 2.973 . . . . 0.0 112.941 168.396 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 46.3 t -128.07 126.11 65.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 125.005 1.322 . . . . 0.0 111.027 -168.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 83.8 mt -92.68 168.31 11.31 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.423 1.889 . . . . 0.0 111.723 174.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 41.2 t-80 -128.19 136.23 50.81 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.43 2.292 . . . . 0.0 106.928 166.478 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 10.7 t -132.77 136.02 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.602 1.161 . . . . 0.0 109.091 -171.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 16.5 m -124.82 135.51 53.0 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.109 1.364 . . . . 0.0 109.689 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -156.2 156.51 30.39 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 124.487 1.115 . . . . 0.0 112.671 -169.165 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.22 150.96 30.54 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.813 3.009 . . . . 0.0 112.644 168.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -56.18 -22.19 27.49 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -62.09 -27.66 69.07 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.456 1.503 . . . . 0.0 113.512 176.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -68.54 150.2 48.32 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.118 0.967 . . . . 0.0 112.968 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 36.0 mttm -135.08 174.29 10.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.366 1.866 . . . . 0.0 112.145 176.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.4 m -48.36 -36.35 14.35 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.026 1.73 . . . . 0.0 112.713 173.869 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.8 m -64.63 -45.33 87.27 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 175.603 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -63.49 -30.93 71.98 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.369 0.668 . . . . 0.0 111.416 175.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 73.6 mt -71.02 -46.62 61.82 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.821 0.849 . . . . 0.0 111.639 175.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -61.95 -31.11 71.42 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.639 -1.288 . . . . 0.0 113.422 171.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -72.65 -34.65 67.41 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.442 1.097 . . . . 0.0 113.26 172.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 65.2 tp -64.5 -30.61 71.64 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.469 1.108 . . . . 0.0 112.253 172.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -115.64 22.95 12.72 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.95 1.3 . . . . 0.0 113.938 -175.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 92.1 p -59.12 -21.61 59.57 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.309 1.043 . . . . 0.0 113.796 172.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -61.73 -19.2 62.16 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.505 1.522 . . . . 0.0 114.047 169.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -115.05 -39.39 3.66 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.389 1.475 . . . . 0.0 111.483 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 65.36 7.98 35.49 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 125.707 1.622 . . . . 0.0 117.06 169.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -143.06 17.61 1.93 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.194 1.398 . . . . 0.0 112.886 -170.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 19.5 pt -64.83 171.37 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 125.636 1.574 . . . . 0.0 113.577 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -134.55 144.05 47.75 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.301 1.441 . . . . 0.0 109.16 169.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 86.4 mt -121.63 133.97 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.154 0.982 . . . . 0.0 109.943 -169.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 71.2 m -134.82 97.03 3.66 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.138 1.775 . . . . 0.0 109.938 -176.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -57.86 158.32 6.61 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 8.9 mt -132.89 -42.93 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.974 1.309 . . . . 0.0 109.537 177.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -155.16 -179.03 7.68 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.461 1.504 . . . . 0.0 111.85 173.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -59.61 -16.16 23.81 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.805 1.642 . . . . 0.0 114.831 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 67.6 p -132.23 3.0 3.95 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.052 1.741 . . . . 0.0 114.577 -173.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 3.6 p -151.8 153.99 35.34 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 170.823 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -150.83 155.03 38.37 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.924 1.29 . . . . 0.0 112.353 -177.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -89.5 148.11 23.6 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.045 0.938 . . . . 0.0 109.517 167.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 56.4 t -138.61 111.24 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.956 0.902 . . . . 0.0 110.652 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 74.0 m -77.42 139.43 39.68 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.333 1.453 . . . . 0.0 111.44 174.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 52.1 mt -110.82 170.8 7.86 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.424 1.49 . . . . 0.0 111.625 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 61.9 m -77.97 -26.04 48.48 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -144.93 148.74 40.04 Favored Pre-proline 0 CA--C 1.544 0.734 0 C-N-CA 125.144 1.378 . . . . 0.0 111.207 178.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -55.1 -29.56 66.29 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.682 2.921 . . . . 0.0 114.551 171.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -59.89 -36.16 76.37 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.524 1.13 . . . . 0.0 113.1 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -67.28 -20.9 65.71 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.458 1.103 . . . . 0.0 113.252 -178.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 96.9 t -60.42 -44.43 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.241 1.016 . . . . 0.0 111.01 176.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -68.03 -35.42 78.24 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.721 0.808 . . . . 0.0 111.497 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 68.2 mt -61.79 -48.29 89.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.813 0.845 . . . . 0.0 110.453 176.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.8 82.31 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 72.0 t -65.9 -41.43 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 O-C-N 121.134 -0.979 . . . . 0.0 111.209 171.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -62.43 -32.31 73.14 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.148 0.979 . . . . 0.0 113.271 176.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 39.4 p -86.24 -27.52 24.4 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.019 0.928 . . . . 0.0 113.086 178.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 11.2 t -69.58 -24.05 63.63 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -60.67 -19.31 58.11 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -90.16 -10.34 44.89 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.305 1.442 . . . . 0.0 114.066 176.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -68.92 152.53 45.16 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.204 1.002 . . . . 0.0 113.535 -173.508 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -140.61 2.93 1.85 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.222 1.409 . . . . 0.0 113.864 175.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 77.4 p -135.84 1.07 2.74 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.271 1.828 . . . . 0.0 113.742 -177.154 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -156.34 175.04 14.53 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.425 2.29 . . . . 0.0 109.591 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 46.3 ttm180 -147.04 146.84 30.15 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.031 1.332 . . . . 0.0 110.984 175.444 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 48.3 mt -129.27 139.48 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.972 1.709 . . . . 0.0 109.055 175.347 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -147.57 171.27 15.84 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.449 1.9 . . . . 0.0 109.829 173.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 19.0 p -72.86 164.01 27.26 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 120.334 -1.479 . . . . 0.0 112.319 172.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -52.85 -44.6 66.88 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.523 0.729 . . . . 0.0 111.518 168.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -69.14 -35.25 76.17 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -63.58 -43.72 96.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.168 0.895 . . . . 0.0 111.965 173.471 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -58.92 -50.82 72.61 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.005 0.522 . . . . 0.0 111.773 174.208 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 45.8 t -57.61 -50.69 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.111 0.965 . . . . 0.0 111.692 176.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -61.92 -38.61 96.3 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 123.482 0.563 . . . . 0.0 113.457 -175.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -66.97 -51.36 56.14 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.079 0.952 . . . . 0.0 111.745 171.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -58.27 -39.35 78.99 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.844 1.658 . . . . 0.0 113.547 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -75.56 -6.76 51.91 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -123.9 -9.93 7.74 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.646 1.721 . . . . 0.0 115.646 -173.271 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 167.45 176.88 38.58 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 120.01 1.277 . . . . 0.0 116.107 169.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.2 161.51 6.96 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.927 1.291 . . . . 0.0 112.742 170.845 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -114.65 7.96 16.13 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.653 1.181 . . . . 0.0 113.116 -173.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 53.0 t -62.75 143.35 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.538 1.535 . . . . 0.0 110.775 172.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -146.46 -45.77 0.19 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.639 1.176 . . . . 0.0 112.82 176.425 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 30.9 m -67.99 167.05 14.58 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.963 1.305 . . . . 0.0 112.959 172.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -163.82 -178.34 37.34 Favored Glycine 0 CA--C 1.539 1.558 0 C-N-CA 124.466 1.031 . . . . 0.0 113.366 175.432 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -52.4 -29.29 38.67 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 124.248 3.299 . . . . 0.0 115.467 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 19.3 m -75.42 -15.19 60.47 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 65.3 m -66.35 152.66 44.55 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.043 0.937 . . . . 0.0 112.948 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.261 0 C-N-CA 125.198 1.38 . . . . 0.0 112.764 178.674 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.725 0 C5'-C4'-O4' 113.697 3.212 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.571 0 N-CA-C 111.439 -0.664 . . . . 0.0 111.439 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 62.9 p -153.5 165.21 36.58 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.223 1.409 . . . . 0.0 112.566 -178.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 48.9 p -66.87 162.79 20.92 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.073 1.349 . . . . 0.0 113.137 173.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 166.6 -27.79 0.17 Allowed Glycine 0 CA--C 1.534 1.248 0 N-CA-C 115.346 0.898 . . . . 0.0 115.346 175.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 9.7 t -149.03 151.25 34.18 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.127 1.371 . . . . 0.0 111.149 176.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 45.9 p -71.2 157.16 38.62 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.337 1.055 . . . . 0.0 113.277 178.084 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -178.6 -23.45 0.03 OUTLIER Glycine 0 CA--C 1.537 1.414 0 N-CA-C 116.069 1.188 . . . . 0.0 116.069 174.145 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 147.02 -61.69 0.46 Allowed Glycine 0 CA--C 1.537 1.449 0 CA-C-N 118.59 1.195 . . . . 0.0 112.578 177.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.45 -27.77 70.02 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 124.046 3.164 . . . . 0.0 113.188 169.081 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -142.73 156.28 44.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.764 2.026 . . . . 0.0 109.847 169.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 95.9 mt -141.8 26.5 1.89 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.703 2.001 . . . . 0.0 111.436 -173.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -125.43 74.01 68.33 Favored Pre-proline 0 CA--C 1.548 0.878 0 C-N-CA 125.671 1.589 . . . . 0.0 111.379 -168.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -69.62 161.19 46.89 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.113 2.542 . . . . 0.0 112.928 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -63.89 11.31 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 126.295 1.838 . . . . 0.0 115.371 172.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -125.09 6.86 7.9 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 127.655 2.382 . . . . 0.0 112.875 176.391 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -60.37 -25.96 66.27 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 120.801 -1.187 . . . . 0.0 113.791 178.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -92.82 18.94 8.17 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.484 1.914 . . . . 0.0 113.737 176.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 24.6 t -125.85 147.44 30.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.773 1.229 . . . . 0.0 111.98 -169.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 74.3 mt -118.45 164.08 15.79 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.568 2.347 . . . . 0.0 110.849 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -122.87 139.2 54.28 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 126.783 2.033 . . . . 0.0 107.772 168.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.0 t -131.34 142.11 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.855 1.262 . . . . 0.0 109.345 -169.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.54 136.16 50.38 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.458 1.503 . . . . 0.0 109.581 -178.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -160.08 157.88 25.69 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 123.598 0.759 . . . . 0.0 112.963 -170.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.65 145.75 68.86 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.757 2.971 . . . . 0.0 112.499 168.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -55.69 -24.59 35.27 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 -176.329 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -67.1 -17.63 64.96 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.985 1.314 . . . . 0.0 114.162 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -62.63 155.08 27.16 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.094 0.958 . . . . 0.0 112.979 173.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -139.53 165.79 26.29 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.528 1.931 . . . . 0.0 110.674 -173.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.7 m -57.03 -32.48 66.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.115 0.966 . . . . 0.0 111.763 176.046 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 43.6 m -66.58 -42.03 87.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 173.331 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -65.79 -31.71 72.83 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.438 -0.789 . . . . 0.0 111.248 174.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.4 mt -70.68 -44.92 66.0 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.861 0.864 . . . . 0.0 111.501 174.262 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -57.51 -38.2 74.26 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.091 -1.006 . . . . 0.0 112.407 169.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -68.29 -40.36 81.8 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.98 0.809 . . . . 0.0 112.999 175.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.0 tp -64.32 -36.02 82.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.842 1.257 . . . . 0.0 112.273 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -106.84 10.42 30.68 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.569 1.148 . . . . 0.0 113.419 -176.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 22.2 t -55.81 -31.74 62.93 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.664 1.586 . . . . 0.0 113.791 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.84 -15.23 11.5 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.443 1.497 . . . . 0.0 115.021 178.068 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -101.63 -0.52 34.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.888 1.275 . . . . 0.0 114.11 -176.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 77.31 -41.73 1.85 Allowed Glycine 0 CA--C 1.536 1.399 0 C-N-CA 126.086 1.803 . . . . 0.0 116.101 169.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -148.59 130.81 15.5 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.282 1.433 . . . . 0.0 110.673 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 18.7 pt -145.92 174.73 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.435 1.494 . . . . 0.0 111.478 -172.351 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.88 146.82 41.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.813 1.245 . . . . 0.0 109.001 168.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 67.9 mt -127.78 130.07 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.032 1.333 . . . . 0.0 109.222 -174.019 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 51.8 m -136.85 94.74 3.01 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.195 1.398 . . . . 0.0 111.022 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -55.83 154.33 7.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.701 1.2 . . . . 0.0 113.633 176.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 17.7 pt -132.27 -28.97 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.474 1.109 . . . . 0.0 113.617 170.61 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -160.15 -175.16 4.91 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.917 1.287 . . . . 0.0 112.44 172.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -57.89 -22.0 46.17 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 -177.197 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.6 p -134.2 5.33 3.53 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.938 1.295 . . . . 0.0 113.979 -171.123 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 60.9 m -143.56 147.92 35.16 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.705 1.202 . . . . 0.0 113.295 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.26 156.23 39.29 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.299 1.44 . . . . 0.0 111.753 175.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -89.9 151.57 21.67 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.557 0.743 . . . . 0.0 110.18 168.115 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.5 t -137.98 115.9 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.496 1.118 . . . . 0.0 110.325 176.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 16.3 m -83.62 140.64 32.08 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.074 1.35 . . . . 0.0 110.673 172.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 80.4 mt -123.18 147.04 47.28 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.769 1.227 . . . . 0.0 110.2 176.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 5.2 m -65.8 -16.01 63.41 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 115.767 1.766 . . . . 0.0 115.767 -172.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -140.25 148.09 52.75 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 124.562 1.145 . . . . 0.0 111.429 175.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -70.0 -20.75 33.29 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.105 2.537 . . . . 0.0 113.579 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -66.59 -32.61 74.06 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.825 -1.172 . . . . 0.0 112.346 172.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -67.29 -31.2 71.35 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.163 0.985 . . . . 0.0 112.189 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.2 t -58.64 -46.42 90.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.242 1.417 . . . . 0.0 110.741 173.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -63.86 -41.92 97.66 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.501 0.72 . . . . 0.0 112.031 176.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 94.6 mt -63.1 -42.55 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.579 0.752 . . . . 0.0 111.292 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.41 -39.72 95.26 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.114 -0.991 . . . . 0.0 113.094 176.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 69.2 t -66.16 -42.02 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 O-C-N 121.218 -0.926 . . . . 0.0 111.347 172.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -61.22 -37.66 83.84 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.121 0.968 . . . . 0.0 113.116 176.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 22.0 p -83.32 -28.87 28.74 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.556 1.142 . . . . 0.0 113.237 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 8.7 t -60.78 -19.38 59.23 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 171.235 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -51.77 -26.54 9.84 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.703 1.601 . . . . 0.0 113.661 169.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -114.9 10.15 16.31 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.606 1.562 . . . . 0.0 113.093 -174.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -64.71 156.56 29.97 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.931 1.293 . . . . 0.0 113.095 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.55 -5.46 1.21 Allowed 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 176.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 51.0 m -137.31 5.08 2.71 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.392 1.477 . . . . 0.0 113.629 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 49.5 p90 -157.92 176.07 13.02 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.241 1.816 . . . . 0.0 111.208 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 69.5 ttt-85 -147.34 145.21 29.24 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.003 2.121 . . . . 0.0 109.997 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 79.2 mt -132.5 141.61 44.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.434 1.494 . . . . 0.0 109.841 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -143.12 163.82 31.81 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.109 1.764 . . . . 0.0 110.509 169.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 65.1 p -73.02 161.51 30.59 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.753 -1.217 . . . . 0.0 112.347 174.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -60.42 -34.15 73.54 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.206 -0.934 . . . . 0.0 111.591 168.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -63.88 -37.82 88.81 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.447 -0.783 . . . . 0.0 113.09 174.308 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -66.52 -42.36 87.41 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.13 -0.982 . . . . 0.0 112.168 170.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -56.74 -47.99 78.8 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 118.777 0.717 . . . . 0.0 111.422 173.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 22.7 t -58.91 -44.18 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.038 1.335 . . . . 0.0 112.288 173.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -62.8 -37.57 95.08 Favored Glycine 0 CA--C 1.536 1.385 0 O-C-N 121.604 -0.685 . . . . 0.0 113.09 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -71.33 -32.0 68.05 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.638 1.175 . . . . 0.0 113.019 169.443 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 18.6 tptp -65.44 -40.22 93.03 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.373 1.469 . . . . 0.0 112.976 176.602 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 56.4 mm-40 -62.45 110.7 1.75 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.262 1.425 . . . . 0.0 111.931 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -148.08 19.15 1.11 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.899 1.28 . . . . 0.0 113.676 -175.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -166.56 36.69 0.24 Allowed Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.13 0.872 . . . . 0.0 114.854 -173.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -62.23 -21.74 65.4 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.893 1.677 . . . . 0.0 114.994 -173.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -73.58 25.48 0.07 Allowed 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 126.662 1.985 . . . . 0.0 115.659 -171.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.4 m -63.54 -14.32 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -75.88 46.87 0.4 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 127.013 2.125 . . . . 0.0 113.589 -175.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 97.4 p -143.35 172.78 12.3 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.775 1.63 . . . . 0.0 112.882 -173.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 60.54 -148.48 44.5 Favored Glycine 0 CA--C 1.543 1.817 0 C-N-CA 123.877 0.751 . . . . 0.0 113.335 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.32 3.12 3.76 Favored 'Trans proline' 0 CA--C 1.548 1.214 0 C-N-CA 123.718 2.945 . . . . 0.0 114.193 177.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 40.9 m -120.25 12.55 11.8 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.071 1.749 . . . . 0.0 113.25 -174.114 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 83.9 p -65.82 -19.36 65.85 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.205 0 C-N-CA 125.53 1.538 . . . . 0.0 112.649 178.713 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.71 0 O5'-C5'-C4' 114.033 2.738 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.54 0 N-CA-C 112.054 -0.419 . . . . 0.0 112.054 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 23.1 m -137.13 9.71 3.0 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.932 1.293 . . . . 0.0 113.888 -172.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 60.2 p -71.9 -12.62 61.35 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -178.52 -172.85 43.33 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.86 1.219 . . . . 0.0 113.62 -178.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 78.8 p -134.86 11.94 3.65 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.648 1.579 . . . . 0.0 113.936 -174.391 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 89.8 p -145.76 170.44 16.52 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.107 1.763 . . . . 0.0 112.264 -178.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -161.18 36.64 0.41 Allowed Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.069 0.842 . . . . 0.0 114.484 -173.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -153.77 58.56 0.4 Allowed Glycine 0 CA--C 1.539 1.582 0 C-N-CA 124.772 1.177 . . . . 0.0 114.083 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -75.86 -2.5 12.68 Favored 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 124.129 3.219 . . . . 0.0 114.794 -175.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -139.98 150.67 44.75 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.184 1.394 . . . . 0.0 112.411 -173.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 84.6 mt -78.84 58.67 2.4 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.632 1.973 . . . . 0.0 112.59 -176.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 42.3 tt0 -52.52 130.99 45.02 Favored Pre-proline 0 CA--C 1.554 1.101 0 C-N-CA 125.302 1.441 . . . . 0.0 112.091 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -74.12 164.86 33.34 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.282 2.655 . . . . 0.0 113.661 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -146.91 165.13 30.7 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.772 2.429 . . . . 0.0 109.65 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -129.0 23.62 5.67 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 125.489 1.515 . . . . 0.0 113.917 -175.072 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -63.35 -22.8 67.1 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 121.087 -1.008 . . . . 0.0 113.543 176.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -90.32 15.36 10.66 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.757 2.023 . . . . 0.0 113.93 175.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 42.5 t -117.59 141.78 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.929 1.292 . . . . 0.0 111.182 -173.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 93.7 mt -108.16 163.58 13.05 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 126.819 2.048 . . . . 0.0 111.489 176.234 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -122.53 136.19 54.83 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.699 2.0 . . . . 0.0 107.026 166.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 4.8 t -132.27 138.59 52.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 124.893 1.277 . . . . 0.0 109.088 -169.383 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.2 m -129.55 136.17 49.49 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.924 1.29 . . . . 0.0 109.529 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -158.85 155.96 25.8 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.404 1.082 . . . . 0.0 112.538 -169.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.13 144.85 78.86 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.5 2.8 . . . . 0.0 111.418 167.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 7.2 ptpt -59.59 -19.14 46.72 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -176.774 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.43 -21.77 66.49 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.696 1.598 . . . . 0.0 114.016 172.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -63.36 150.94 42.21 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.002 0.819 . . . . 0.0 112.276 172.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -130.73 169.1 16.14 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.329 1.852 . . . . 0.0 111.634 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.5 m -50.92 -34.46 28.63 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.652 1.181 . . . . 0.0 112.513 171.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 43.2 m -66.19 -40.18 90.24 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -66.82 -31.97 72.93 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.608 -0.683 . . . . 0.0 111.168 173.427 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 90.8 mt -70.56 -41.38 72.52 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.615 0.766 . . . . 0.0 111.485 174.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -60.55 -42.22 96.12 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.959 -1.088 . . . . 0.0 111.634 169.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.3 tt0 -60.78 -33.91 73.68 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.122 -0.986 . . . . 0.0 112.681 175.114 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 44.9 tp -79.49 -27.23 41.48 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.849 1.26 . . . . 0.0 114.105 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -128.76 -17.5 4.02 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 116.888 2.181 . . . . 0.0 116.888 -168.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 14.8 t -60.87 -21.8 63.63 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.63 1.559 . . . . 0.0 113.43 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -54.36 -24.32 19.01 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.413 1.485 . . . . 0.0 114.521 171.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -80.46 -1.23 40.75 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 99.77 -44.67 1.61 Allowed Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.705 1.622 . . . . 0.0 114.541 168.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -152.69 136.91 16.54 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.12 1.368 . . . . 0.0 110.391 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 29.1 pt -144.42 171.79 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.679 1.191 . . . . 0.0 112.298 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -143.89 145.82 32.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.133 1.373 . . . . 0.0 109.146 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 77.0 mt -127.15 128.71 70.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.752 1.221 . . . . 0.0 109.158 -172.462 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 46.3 m -136.18 99.38 4.11 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.455 1.502 . . . . 0.0 111.071 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -58.42 151.1 20.74 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.196 0.998 . . . . 0.0 113.63 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 38.2 pt -133.59 -19.84 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.778 1.231 . . . . 0.0 113.278 169.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -152.0 178.19 9.69 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.743 1.217 . . . . 0.0 111.713 172.826 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -66.17 -14.66 62.21 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.158 1.783 . . . . 0.0 112.926 174.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.0 p -134.64 5.03 3.39 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.598 1.959 . . . . 0.0 113.718 -172.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 88.0 p -155.05 154.9 33.16 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.39 161.5 42.25 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.663 1.585 . . . . 0.0 112.088 -177.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -93.48 149.66 21.06 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.982 0.913 . . . . 0.0 110.054 167.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.2 t -138.3 114.91 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.174 0.99 . . . . 0.0 110.746 177.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 19.3 m -77.61 141.21 39.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.835 1.254 . . . . 0.0 111.066 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 70.7 mt -121.08 165.62 15.07 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.42 1.488 . . . . 0.0 110.621 171.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 55.0 m -63.67 -29.66 70.86 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -146.47 152.4 45.71 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.628 1.171 . . . . 0.0 112.385 -176.703 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.37 -17.23 39.45 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.329 2.686 . . . . 0.0 113.497 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -63.23 -35.61 80.9 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.616 -1.303 . . . . 0.0 111.539 169.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -74.96 -30.57 61.25 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.125 0.97 . . . . 0.0 112.356 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 13.5 t -57.02 -44.96 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.008 0.923 . . . . 0.0 111.173 171.014 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -60.81 -41.27 95.34 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.107 0.563 . . . . 0.0 112.272 176.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 98.8 mt -61.43 -50.64 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.806 0.842 . . . . 0.0 110.668 176.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.87 -36.54 83.64 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 78.3 t -65.75 -41.16 89.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 121.117 -0.989 . . . . 0.0 111.242 171.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -63.2 -43.84 97.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.795 0.725 . . . . 0.0 112.832 176.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 35.3 p -68.86 -27.82 66.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.708 0.803 . . . . 0.0 113.068 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.3 t -65.53 -18.24 65.18 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 174.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -60.29 -14.32 17.52 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.702 1.201 . . . . 0.0 114.043 176.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -128.95 13.29 6.27 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.076 1.75 . . . . 0.0 112.609 -176.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.05 159.21 23.69 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.997 1.319 . . . . 0.0 113.044 175.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -138.06 -0.99 2.01 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -178.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 8.7 t -145.03 4.74 1.1 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.218 1.407 . . . . 0.0 113.006 -178.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -159.27 174.85 14.16 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.378 1.471 . . . . 0.0 111.637 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 79.2 ttt-85 -145.01 147.82 33.05 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.386 1.874 . . . . 0.0 110.313 169.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 68.4 mt -129.1 141.45 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.336 1.855 . . . . 0.0 109.611 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -144.52 166.07 26.2 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.932 1.693 . . . . 0.0 109.728 169.031 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 25.7 p -71.79 162.28 29.68 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.696 -1.252 . . . . 0.0 111.677 175.15 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -57.09 -39.19 74.52 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.278 -0.889 . . . . 0.0 111.829 168.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.76 -36.97 86.02 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -67.33 -40.96 85.95 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.171 -0.956 . . . . 0.0 112.145 173.368 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -59.55 -49.11 79.03 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.42 0.555 . . . . 0.0 111.476 172.605 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 21.0 t -56.72 -45.23 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.647 1.179 . . . . 0.0 111.924 174.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -63.3 -40.56 99.12 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 123.714 0.673 . . . . 0.0 113.287 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -68.76 -28.09 66.48 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 118.169 0.985 . . . . 0.0 113.546 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -74.69 -17.19 60.71 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.724 1.61 . . . . 0.0 114.143 179.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -59.71 151.77 24.3 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.288 1.035 . . . . 0.0 112.869 175.365 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -145.53 20.55 1.51 Allowed 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -173.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -88.01 152.22 23.58 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 124.044 0.83 . . . . 0.0 113.688 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -158.62 150.81 21.53 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.271 1.828 . . . . 0.0 110.258 178.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -56.31 -36.67 68.96 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -176.181 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.96 -20.68 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 125.558 1.543 . . . . 0.0 113.707 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -89.77 -0.45 57.56 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.816 1.647 . . . . 0.0 112.93 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 22.5 m 65.39 -31.76 0.14 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 129.3 3.04 . . . . 0.0 117.588 174.366 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 169.16 52.98 0.03 OUTLIER Glycine 0 CA--C 1.537 1.444 0 CA-C-N 119.747 1.158 . . . . 0.0 115.246 178.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -67.73 -28.98 36.45 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 122.802 2.335 . . . . 0.0 113.065 -177.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 18.2 m -72.52 -13.41 61.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.214 1.405 . . . . 0.0 114.243 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 44.5 m -72.03 -11.17 60.64 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -175.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.199 0 C-N-CA 124.969 1.271 . . . . 0.0 113.044 178.93 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . 0.5 ' H81' " O4'" ' A' ' 524' ' ' GDP . . . . . . . . 0 O4'--C4' 1.418 -2.927 0 C5'-C4'-O4' 113.169 2.835 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 524' ' ' GDP . . . . . 0.5 " O4'" ' H81' ' A' ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 N-CA-C 112.249 -0.341 . . . . 0.0 112.249 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 50.5 m -135.67 6.34 3.2 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.081 1.352 . . . . 0.0 113.817 -171.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 15.0 m -78.46 35.42 0.23 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 127.071 2.148 . . . . 0.0 114.791 -169.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -169.09 -149.06 6.04 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 125.348 1.451 . . . . 0.0 112.01 -175.237 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 31.8 p -59.83 -15.13 18.55 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 169.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 19.3 p -69.23 -11.77 61.09 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.399 2.279 . . . . 0.0 115.941 178.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -170.47 -179.45 41.89 Favored Glycine 0 CA--C 1.534 1.258 0 CA-C-N 119.882 1.219 . . . . 0.0 114.977 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 167.21 -158.19 31.0 Favored Glycine 0 CA--C 1.539 1.545 0 C-N-CA 124.186 0.898 . . . . 0.0 113.011 -174.363 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.73 -19.55 10.92 Favored 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 124.717 3.611 . . . . 0.0 115.551 170.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -135.02 155.74 50.25 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.407 1.883 . . . . 0.0 110.524 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.2 pp -69.22 -5.98 26.13 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 -173.699 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -146.99 81.0 9.21 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 126.771 2.028 . . . . 0.0 109.244 178.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -57.34 152.39 46.69 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.418 2.745 . . . . 0.0 113.795 177.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.27 -14.91 2.93 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 173.786 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 73.4 mtt180 28.95 52.04 0.07 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 129.798 3.239 . . . . 0.0 116.077 170.089 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.29 -15.57 57.64 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 -96.27 13.79 26.36 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.909 2.084 . . . . 0.0 113.695 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 55.4 t -128.0 143.5 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.915 1.286 . . . . 0.0 111.777 -171.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 72.1 mt -107.16 166.3 10.73 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 127.342 2.257 . . . . 0.0 111.496 175.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 22.8 t-80 -121.53 137.55 54.68 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.974 2.11 . . . . 0.0 107.103 166.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 13.4 t -133.81 139.72 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.877 1.271 . . . . 0.0 108.958 -169.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.0 m -128.72 132.52 47.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.193 1.397 . . . . 0.0 109.252 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -151.49 159.71 32.93 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.444 1.098 . . . . 0.0 112.895 -168.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -52.15 150.15 19.96 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.19 3.26 . . . . 0.0 114.058 170.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.0 pttm -53.67 -28.05 31.1 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.456 1.503 . . . . 0.0 115.048 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -81.55 -12.91 58.63 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.406 1.483 . . . . 0.0 114.212 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 7.6 m0 -65.63 152.8 43.31 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.305 0.957 . . . . 0.0 112.982 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -129.72 168.93 15.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.403 1.881 . . . . 0.0 111.832 -178.861 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.2 m -48.53 -35.45 13.29 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.444 1.498 . . . . 0.0 112.213 169.35 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 70.8 m -64.41 -43.72 93.5 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -64.54 -33.18 75.32 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.751 -0.593 . . . . 0.0 111.147 174.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.92 -44.57 65.91 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.87 0.868 . . . . 0.0 111.792 176.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.38 -43.42 92.91 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.166 -0.959 . . . . 0.0 112.018 169.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -61.43 -32.21 72.17 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.923 0.783 . . . . 0.0 112.977 175.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 52.7 tp -74.83 -34.3 62.31 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.499 1.12 . . . . 0.0 113.254 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -116.53 -5.88 11.69 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -169.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 87.1 p -57.62 -22.88 48.0 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 114.549 1.315 . . . . 0.0 114.549 175.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.4 -21.62 51.21 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.063 1.345 . . . . 0.0 114.17 173.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -94.24 -5.89 45.86 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.157 1.383 . . . . 0.0 113.779 177.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 109.69 -154.07 16.68 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 125.071 1.319 . . . . 0.0 112.213 -173.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -61.37 153.61 26.34 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.652 0.781 . . . . 0.0 112.13 169.46 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 33.0 pt -142.54 176.92 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 125.389 1.476 . . . . 0.0 111.795 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -143.82 146.16 32.87 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.2 1.4 . . . . 0.0 108.926 169.03 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 77.8 mt -129.48 133.28 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.679 1.192 . . . . 0.0 109.289 -172.402 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 39.5 m -134.78 97.38 3.76 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.742 1.617 . . . . 0.0 110.497 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -60.01 153.29 21.79 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.731 1.212 . . . . 0.0 113.955 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 28.9 pt -133.44 -24.47 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.817 1.247 . . . . 0.0 112.9 169.501 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -149.75 173.18 14.0 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.748 1.619 . . . . 0.0 112.064 173.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.81 -20.48 50.6 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.557 1.543 . . . . 0.0 113.66 169.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.4 p -126.58 0.93 6.86 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.046 1.738 . . . . 0.0 114.197 -172.09 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 36.3 p -154.4 151.26 28.8 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 174.28 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.87 160.58 43.08 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.617 1.567 . . . . 0.0 111.96 -176.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -89.13 149.76 23.02 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.448 0.699 . . . . 0.0 110.341 167.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 48.5 t -138.53 119.15 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 124.564 1.146 . . . . 0.0 110.773 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 14.1 t -80.99 144.52 31.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.191 1.396 . . . . 0.0 111.881 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 86.0 mt -129.66 155.6 45.61 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.737 1.615 . . . . 0.0 110.871 174.364 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 48.9 m -68.85 -24.17 64.33 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -169.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -137.99 151.45 70.12 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.75 1.22 . . . . 0.0 111.527 172.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -67.97 -18.63 46.42 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.262 2.641 . . . . 0.0 113.744 174.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.17 -37.93 89.24 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.662 -1.274 . . . . 0.0 111.98 170.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.3 -32.94 74.26 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.405 -0.81 . . . . 0.0 112.092 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.8 t -58.93 -47.28 90.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.79 1.236 . . . . 0.0 110.506 172.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -62.48 -42.87 99.79 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.571 -0.706 . . . . 0.0 112.211 176.252 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 87.4 mt -62.76 -43.81 99.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 123.76 0.824 . . . . 0.0 111.368 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.1 -38.56 91.68 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.324 -0.86 . . . . 0.0 113.069 177.157 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 71.1 t -66.76 -42.47 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 121.283 -0.886 . . . . 0.0 111.364 173.002 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -60.79 -44.44 96.8 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.032 0.833 . . . . 0.0 112.661 176.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 26.1 p -74.69 -21.74 59.23 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.224 1.009 . . . . 0.0 113.649 -178.008 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 21.2 p -65.2 -15.17 62.17 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 175.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -56.41 -15.14 3.64 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.671 1.588 . . . . 0.0 114.122 172.285 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -126.93 16.04 7.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.286 1.834 . . . . 0.0 112.333 -174.528 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.51 -36.75 84.77 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -174.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 52.68 -18.65 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 129.751 3.22 . . . . 0.0 118.906 -175.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 50.2 m -135.48 1.36 2.86 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.226 1.411 . . . . 0.0 114.371 -173.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -155.58 176.14 12.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.183 2.193 . . . . 0.0 109.56 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -144.6 150.26 37.15 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.289 1.036 . . . . 0.0 111.767 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 78.2 mt -135.66 144.11 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 126.083 1.753 . . . . 0.0 109.5 -177.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -147.54 168.63 21.47 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.148 1.779 . . . . 0.0 110.376 169.535 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 18.6 p -71.65 163.59 27.48 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 120.659 -1.276 . . . . 0.0 111.702 172.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -55.35 -42.06 73.35 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.272 -0.892 . . . . 0.0 112.308 169.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.25 92.94 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.653 0.781 . . . . 0.0 112.868 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.45 -31.9 72.4 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.442 -0.786 . . . . 0.0 112.66 175.359 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -67.24 -49.98 62.4 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.063 0.847 . . . . 0.0 111.415 169.016 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 8.6 t -53.64 -42.03 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.502 1.121 . . . . 0.0 111.795 178.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -68.71 -9.97 60.01 Favored Glycine 0 CA--C 1.54 1.634 0 N-CA-C 115.468 0.947 . . . . 0.0 115.468 178.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -114.02 -15.77 12.25 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.805 1.642 . . . . 0.0 113.971 176.129 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 40.7 tttp -46.37 -36.54 6.51 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 126.62 1.968 . . . . 0.0 115.063 -170.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -66.75 -20.79 66.03 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -177.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -147.62 -18.76 0.37 Allowed 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 -172.585 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -57.67 -23.94 51.52 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 126.136 1.826 . . . . 0.0 116.902 -169.835 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -141.27 156.62 45.85 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.134 1.373 . . . . 0.0 111.234 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -132.61 21.22 4.27 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.099 1.36 . . . . 0.0 113.054 -168.475 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 13.7 p -143.44 147.26 20.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 125.207 1.403 . . . . 0.0 111.309 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -140.94 -21.09 0.79 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 125.574 1.55 . . . . 0.0 114.152 -174.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 45.9 m -145.81 166.43 25.96 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.66 1.584 . . . . 0.0 111.848 -175.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -170.1 176.67 43.75 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.668 1.128 . . . . 0.0 113.494 178.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -72.29 -10.86 26.24 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.118 3.212 . . . . 0.0 114.539 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 57.4 p -60.61 -15.85 32.39 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.489 1.516 . . . . 0.0 114.962 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 83.3 p -69.09 -17.01 63.81 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 173.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.266 0 CA-C-O 118.308 -1.273 . . . . 0.0 113.423 179.669 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.03 0 C5'-C4'-O4' 112.891 2.637 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.559 0 N-CA-C 111.883 -0.487 . . . . 0.0 111.883 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 82.5 p -140.41 10.57 2.3 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -174.107 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 17.4 m 57.37 23.47 8.99 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.991 1.717 . . . . 0.0 115.038 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -164.22 172.25 39.98 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 124.998 1.285 . . . . 0.0 113.222 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 20.4 m -57.79 -19.36 27.76 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.434 1.642 . . . . 0.0 115.434 -170.303 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 19.7 m -65.77 -19.41 65.88 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.182 1.393 . . . . 0.0 114.488 175.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -179.95 5.95 0.02 OUTLIER Glycine 0 CA--C 1.538 1.52 0 N-CA-C 118.263 2.065 . . . . 0.0 118.263 -177.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 177.26 61.38 0.06 OUTLIER Glycine 0 CA--C 1.537 1.408 0 CA-C-N 120.175 1.987 . . . . 0.0 114.748 176.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -70.52 168.11 23.49 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.474 2.783 . . . . 0.0 113.163 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -144.23 138.65 28.17 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.145 1.378 . . . . 0.0 110.337 169.255 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.88 17.11 0.98 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.114 1.766 . . . . 0.0 113.278 -173.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -53.82 147.2 24.19 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 124.873 1.269 . . . . 0.0 113.614 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.37 164.17 36.62 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.233 2.622 . . . . 0.0 112.612 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -127.31 16.4 7.15 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.743 1.617 . . . . 0.0 112.864 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 51.38 21.17 1.12 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 128.291 2.636 . . . . 0.0 115.696 -175.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -66.91 -17.01 64.7 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.246 1.419 . . . . 0.0 113.234 169.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -95.2 14.67 21.42 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.899 2.08 . . . . 0.0 113.386 175.52 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 39.8 t -122.19 142.9 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 124.856 1.263 . . . . 0.0 111.583 -170.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 76.5 mt -114.12 164.35 13.97 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 127.328 2.251 . . . . 0.0 110.868 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -120.95 140.24 52.14 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.875 2.07 . . . . 0.0 107.772 168.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.5 t -133.62 142.79 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 C-N-CA 124.776 1.23 . . . . 0.0 109.15 -169.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 12.2 m -132.27 134.05 44.82 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.215 1.406 . . . . 0.0 109.581 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -158.55 157.32 28.6 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.293 1.037 . . . . 0.0 112.561 -169.495 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.83 144.17 78.24 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 123.53 2.82 . . . . 0.0 112.179 168.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -55.2 -24.27 26.3 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.44 -13.96 54.32 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.247 1.419 . . . . 0.0 114.554 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -68.99 156.0 39.37 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.5 1.12 . . . . 0.0 112.877 172.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -129.16 170.11 13.95 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.381 1.872 . . . . 0.0 111.058 174.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.1 m -51.81 -33.53 36.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.788 1.235 . . . . 0.0 111.943 169.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.3 m -64.83 -42.3 95.07 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 175.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -66.31 -31.8 72.81 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.626 -0.671 . . . . 0.0 111.094 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.2 mt -70.98 -43.02 68.92 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.78 0.832 . . . . 0.0 111.395 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -57.47 -44.1 84.6 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.926 -1.109 . . . . 0.0 111.511 169.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -62.45 -33.51 74.96 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 50.7 tp -73.93 -29.72 62.18 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.444 1.098 . . . . 0.0 113.412 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -120.38 -4.39 9.9 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.947 1.832 . . . . 0.0 115.947 -169.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 86.5 p -59.42 -20.24 53.46 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 173.405 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -60.77 -9.19 3.68 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.923 1.689 . . . . 0.0 114.87 172.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -119.28 14.97 13.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.745 1.618 . . . . 0.0 113.398 -172.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 89.31 -149.41 20.67 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.484 1.04 . . . . 0.0 112.704 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -62.58 142.55 57.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.482 0.713 . . . . 0.0 111.281 170.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 38.5 pt -142.57 174.16 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.489 1.515 . . . . 0.0 111.698 -176.755 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -138.79 142.37 38.74 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.897 1.279 . . . . 0.0 109.044 168.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 69.8 mt -122.33 124.89 71.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 125.067 1.347 . . . . 0.0 108.471 -176.633 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 75.7 m -135.25 94.83 3.18 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.416 1.486 . . . . 0.0 110.904 -169.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 86.7 m95 -56.27 152.72 10.6 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.325 1.05 . . . . 0.0 113.648 178.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 27.4 pt -129.88 -22.59 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 124.707 1.203 . . . . 0.0 113.206 170.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.43 -174.12 3.88 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.713 2.005 . . . . 0.0 110.233 169.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -74.08 -5.32 40.91 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -176.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 69.5 p -135.44 2.15 2.95 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 119.757 1.162 . . . . 0.0 114.064 -177.246 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 45.5 m -144.51 150.57 37.79 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.411 1.485 . . . . 0.0 113.295 173.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.6 156.89 41.37 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.195 1.398 . . . . 0.0 111.588 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -89.87 151.1 21.92 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.492 0.717 . . . . 0.0 109.874 167.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 63.1 t -138.34 114.53 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 124.137 0.975 . . . . 0.0 110.536 176.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 32.5 m -79.32 138.93 37.9 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.687 1.195 . . . . 0.0 110.533 171.195 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 56.1 mt -113.81 164.49 13.67 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.526 1.13 . . . . 0.0 111.703 175.752 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 22.7 t -55.49 -40.96 72.37 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.478 1.111 . . . . 0.0 113.452 -175.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -146.51 160.86 40.48 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.324 1.85 . . . . 0.0 110.982 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.88 -12.45 30.79 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.334 2.689 . . . . 0.0 114.074 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -61.53 -38.91 89.15 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.983 -1.073 . . . . 0.0 112.445 173.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -76.54 -20.4 56.91 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.069 0.948 . . . . 0.0 113.309 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.42 -44.58 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 124.653 1.181 . . . . 0.0 110.59 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -61.91 -40.47 95.58 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.698 0.799 . . . . 0.0 112.183 174.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 57.0 mt -65.12 -45.7 93.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.482 0.713 . . . . 0.0 110.843 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.5 -36.0 82.33 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 177.705 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 79.0 t -65.52 -40.93 89.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 120.987 -1.07 . . . . 0.0 110.992 170.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -63.13 -39.96 96.19 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.847 0.859 . . . . 0.0 113.156 176.111 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 44.2 p -76.68 -31.05 57.01 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.798 0.839 . . . . 0.0 112.842 -178.798 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.2 t -61.17 -19.58 61.74 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 173.393 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -54.16 -22.63 11.75 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.539 1.535 . . . . 0.0 113.54 169.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -122.73 10.38 9.63 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.903 1.681 . . . . 0.0 113.144 -175.3 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -66.45 157.33 32.29 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.513 1.125 . . . . 0.0 112.83 175.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.43 -5.1 1.24 Allowed 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 50.6 m -135.55 4.47 3.11 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.347 1.459 . . . . 0.0 113.468 -178.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.9 p90 -161.59 175.18 12.35 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.096 2.158 . . . . 0.0 110.213 -177.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 54.9 ttt85 -147.44 151.75 36.95 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.442 1.497 . . . . 0.0 111.17 169.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 49.3 mt -132.46 142.29 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 126.019 1.727 . . . . 0.0 110.091 -175.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.7 pt20 -145.34 171.43 14.61 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.304 1.841 . . . . 0.0 110.137 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 44.7 p -72.18 160.85 31.75 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 120.481 -1.387 . . . . 0.0 112.325 174.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -55.29 -43.01 74.37 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.5 -0.75 . . . . 0.0 111.565 168.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.75 -38.05 89.68 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.888 0.875 . . . . 0.0 113.31 179.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.04 -45.54 93.12 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.424 -0.798 . . . . 0.0 112.072 173.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -61.36 -48.6 80.54 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.51 0.595 . . . . 0.0 111.817 174.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 18.0 t -54.03 -41.59 50.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 124.342 1.057 . . . . 0.0 112.18 175.786 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -70.24 -12.78 69.53 Favored Glycine 0 CA--C 1.54 1.599 0 N-CA-C 115.424 0.93 . . . . 0.0 115.424 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.35 -1.45 6.3 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -20.82 84.57 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 131.266 3.826 . . . . 0.0 115.688 -174.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -61.77 -16.68 51.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.561 1.544 . . . . 0.0 114.351 -174.377 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -75.15 -9.79 58.87 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.344 1.458 . . . . 0.0 114.566 174.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -120.98 127.55 7.04 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.505 1.05 . . . . 0.0 113.391 -175.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -58.31 -25.88 62.39 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.629 1.572 . . . . 0.0 113.7 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -71.57 -8.22 52.61 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.158 1.783 . . . . 0.0 113.977 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 1.1 t -130.09 14.96 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 125.409 1.484 . . . . 0.0 112.166 -169.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -149.2 160.31 43.48 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.509 1.523 . . . . 0.0 113.008 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 50.0 m -76.77 163.13 27.1 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.721 1.208 . . . . 0.0 112.482 172.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -177.53 172.51 45.26 Favored Glycine 0 CA--C 1.541 1.693 0 C-N-CA 124.219 0.914 . . . . 0.0 114.103 173.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.71 155.29 22.54 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 124.373 3.382 . . . . 0.0 114.714 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 50.1 m -60.69 110.22 1.24 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.833 1.253 . . . . 0.0 111.342 172.023 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 64.6 p -146.76 7.29 0.95 Allowed 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -170.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.183 0 C-N-CA 125.425 1.488 . . . . 0.0 112.963 178.53 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.52 0 C5'-C4'-O4' 113.19 2.85 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.469 0 N-CA-C 111.886 -0.486 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 78.0 p -136.67 -2.45 2.16 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 87.4 p -155.8 165.03 37.72 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.682 1.593 . . . . 0.0 111.931 176.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 172.23 174.22 39.47 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.468 1.032 . . . . 0.0 113.776 177.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 88.3 p -156.92 168.42 27.53 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.452 1.501 . . . . 0.0 112.294 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 37.3 m -133.94 10.19 3.9 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.237 1.415 . . . . 0.0 113.301 -177.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 169.76 -171.64 43.38 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 125.755 1.645 . . . . 0.0 112.595 -176.416 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -167.8 171.93 42.42 Favored Glycine 0 CA--C 1.539 1.587 0 C-N-CA 124.053 0.835 . . . . 0.0 114.004 175.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -53.05 132.9 49.9 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 124.588 3.525 . . . . 0.0 114.635 -178.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -143.73 4.55 1.33 Allowed 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 173.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 433' ' ' LEU . . . . . 0.476 HD23 ' H ' ' A' ' 433' ' ' LEU . 2.5 pt? -64.16 176.57 0.98 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.284 1.834 . . . . 0.0 113.61 169.711 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -134.42 146.11 58.01 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.871 1.668 . . . . 0.0 110.003 169.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.06 126.65 12.02 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 122.99 2.46 . . . . 0.0 112.809 -171.714 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -154.81 176.35 12.59 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.818 2.047 . . . . 0.0 110.743 170.635 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 86.9 mmt-85 -135.97 -6.76 2.11 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -174.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -67.35 -2.72 6.56 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 177.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 37.2 p-80 -117.3 12.86 14.45 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.322 1.849 . . . . 0.0 113.06 175.041 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 45.2 t -116.43 125.81 73.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.635 1.174 . . . . 0.0 111.849 -169.672 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.72 167.97 11.31 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.91 1.684 . . . . 0.0 111.693 169.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -128.13 136.68 51.48 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 127.052 2.141 . . . . 0.0 106.806 166.047 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 11.6 t -132.98 136.86 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.606 1.163 . . . . 0.0 109.131 -169.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 19.0 m -125.89 134.1 51.7 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.055 1.342 . . . . 0.0 109.423 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.9 p90 -156.78 156.98 30.58 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 124.362 1.065 . . . . 0.0 112.462 -168.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.24 145.22 67.18 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.548 2.832 . . . . 0.0 112.193 168.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -55.71 -22.96 26.17 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.362 1.615 . . . . 0.0 115.362 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.71 -12.86 61.42 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.398 1.479 . . . . 0.0 114.329 177.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -70.34 156.31 39.48 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.371 1.068 . . . . 0.0 113.115 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -131.82 170.23 15.13 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.387 1.875 . . . . 0.0 111.727 174.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.3 m -48.17 -37.84 16.63 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.199 1.8 . . . . 0.0 111.857 169.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.7 m -62.31 -45.25 94.07 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -64.56 -30.7 71.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.264 0.626 . . . . 0.0 111.529 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 77.1 mt -72.82 -46.45 53.05 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.853 0.861 . . . . 0.0 111.867 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -61.82 -31.9 72.17 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.774 -1.204 . . . . 0.0 112.809 170.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -69.9 -35.82 74.92 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.095 0.862 . . . . 0.0 112.787 172.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.1 -32.74 74.6 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.754 1.222 . . . . 0.0 112.251 175.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -114.02 13.41 18.19 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 -174.032 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 90.6 p -56.91 -26.37 59.01 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 178.938 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.48 -21.96 60.87 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.312 1.445 . . . . 0.0 114.466 174.657 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -92.98 -2.44 55.75 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.785 1.234 . . . . 0.0 113.703 177.008 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 78.84 -45.21 2.68 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 125.911 1.72 . . . . 0.0 114.248 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -145.54 151.31 37.94 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.649 1.58 . . . . 0.0 111.416 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 19.9 pt -149.36 178.94 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 127.28 2.232 . . . . 0.0 110.258 173.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -141.96 144.61 33.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.152 1.381 . . . . 0.0 109.007 167.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 66.0 mt -123.79 137.55 56.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.897 0.879 . . . . 0.0 110.585 -169.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 69.5 m -135.17 95.28 3.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.184 1.794 . . . . 0.0 109.932 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -58.86 152.25 19.74 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.996 0.919 . . . . 0.0 113.233 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 39.2 pt -134.74 -20.94 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.679 1.192 . . . . 0.0 113.524 172.425 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -153.32 175.6 12.92 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.649 1.179 . . . . 0.0 111.686 173.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -64.8 -13.34 55.21 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.803 1.641 . . . . 0.0 113.569 174.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 42.0 p -133.97 3.16 3.44 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.684 1.594 . . . . 0.0 113.928 -174.067 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 51.8 p -154.86 157.24 37.54 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 171.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.29 157.2 39.77 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.542 1.537 . . . . 0.0 111.831 -175.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -89.83 149.26 22.75 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.457 0.703 . . . . 0.0 110.176 167.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 42.6 t -138.17 111.12 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 124.135 0.974 . . . . 0.0 110.57 -179.485 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 58.5 m -75.81 139.05 41.56 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.355 1.462 . . . . 0.0 111.059 171.206 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 45.7 mt -113.15 159.7 18.99 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.178 1.391 . . . . 0.0 111.436 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 68.3 m -67.17 -26.38 66.61 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -143.09 147.11 39.68 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 124.876 1.271 . . . . 0.0 111.889 176.161 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.1 -33.13 82.64 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 123.896 3.064 . . . . 0.0 114.716 173.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.9 -29.5 70.25 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.178 -0.951 . . . . 0.0 113.175 178.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.69 -24.68 64.53 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.155 0.982 . . . . 0.0 112.51 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 66.4 t -62.37 -43.24 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.233 1.013 . . . . 0.0 110.539 175.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -63.44 -39.51 94.66 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.654 0.782 . . . . 0.0 111.894 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 82.6 mt -63.79 -47.39 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.913 0.885 . . . . 0.0 110.645 176.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.24 -39.86 94.81 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.62 -43.08 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.466 0.706 . . . . 0.0 111.324 173.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -62.98 -46.76 86.16 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.022 0.828 . . . . 0.0 112.678 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 29.9 p -74.33 -20.3 60.15 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -175.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 25.5 p -57.8 -24.81 59.06 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 173.694 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -56.49 -20.45 20.26 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.694 1.998 . . . . 0.0 114.016 174.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -109.36 4.79 22.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.312 1.445 . . . . 0.0 113.689 -174.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -64.9 159.69 22.2 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.03 0.932 . . . . 0.0 113.136 176.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -138.43 -2.46 1.79 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.009 1.324 . . . . 0.0 114.051 174.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 76.1 p -148.64 5.95 0.71 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.172 1.389 . . . . 0.0 114.364 -172.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -158.99 173.25 16.79 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.479 1.912 . . . . 0.0 110.741 -178.753 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -140.83 154.98 46.45 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.171 1.788 . . . . 0.0 110.982 169.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 62.0 mt -135.93 142.68 38.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.952 1.701 . . . . 0.0 109.058 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -149.96 173.68 13.54 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.222 1.809 . . . . 0.0 110.661 172.593 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 37.6 p -74.65 163.36 27.81 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 120.713 -1.242 . . . . 0.0 112.248 172.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -55.86 -42.02 75.25 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.285 -0.885 . . . . 0.0 112.053 169.25 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.63 91.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.113 0.965 . . . . 0.0 113.27 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -62.79 -43.67 98.18 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.437 -0.789 . . . . 0.0 112.133 172.843 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -60.96 -48.06 83.54 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.699 0.681 . . . . 0.0 111.985 175.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 9.3 t -52.37 -37.7 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.487 1.115 . . . . 0.0 113.023 178.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -78.06 -46.56 9.19 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 121.796 -0.565 . . . . 0.0 113.257 177.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -73.34 -24.32 60.35 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 -176.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -58.66 -30.78 67.59 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.499 1.92 . . . . 0.0 113.504 175.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -71.62 100.56 2.32 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.532 1.533 . . . . 0.0 110.958 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -140.4 161.96 36.45 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.895 1.678 . . . . 0.0 112.496 -172.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -144.29 3.4 1.43 Allowed Glycine 0 CA--C 1.538 1.497 0 C-N-CA 125.538 1.542 . . . . 0.0 114.982 174.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -116.15 -9.82 11.59 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.86 1.664 . . . . 0.0 113.886 -171.418 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -128.98 16.82 6.23 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.073 1.749 . . . . 0.0 112.382 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 36.0 m -129.51 2.04 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 125.515 1.526 . . . . 0.0 114.048 -169.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 54.9 mttp -76.15 -2.63 32.01 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.071 1.349 . . . . 0.0 114.327 176.736 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 87.6 p -141.26 172.68 12.34 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.886 1.674 . . . . 0.0 112.718 -175.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -147.23 66.73 0.4 Allowed Glycine 0 CA--C 1.537 1.412 0 C-N-CA 125.23 1.395 . . . . 0.0 112.802 -175.294 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.42 -16.97 34.85 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.707 2.938 . . . . 0.0 114.367 -175.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 77.5 p -141.85 2.2 1.54 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.226 1.41 . . . . 0.0 114.439 -175.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 85.5 p -155.79 164.62 38.31 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.51 1.524 . . . . 0.0 112.313 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.257 0 C-N-CA 125.041 1.305 . . . . 0.0 112.852 -179.808 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.726 0 C5'-C4'-O4' 111.923 1.945 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.656 0 N-CA-C 112.048 -0.421 . . . . 0.0 112.048 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 77.4 p -140.65 10.52 2.25 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.261 1.424 . . . . 0.0 114.059 -175.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 14.8 m -75.22 25.2 0.1 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.106 2.162 . . . . 0.0 115.356 -172.854 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -159.68 -178.22 33.48 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.932 1.253 . . . . 0.0 114.538 -175.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 19.8 m -57.9 154.49 12.17 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.628 1.571 . . . . 0.0 114.105 -176.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 5.0 t -134.69 1.24 3.06 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.71 1.374 . . . . 0.0 114.71 -175.503 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 157.54 -36.96 0.55 Allowed Glycine 0 CA--C 1.534 1.247 0 O-C-N 121.331 -0.856 . . . . 0.0 115.146 170.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 165.29 -168.62 39.44 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 118.037 0.919 . . . . 0.0 114.077 -175.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -72.42 2.45 5.09 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 124.664 3.576 . . . . 0.0 114.543 178.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -63.74 1.4 0.62 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.987 2.115 . . . . 0.0 115.466 -179.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.69 11.38 9.12 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 127.188 2.195 . . . . 0.0 113.769 -178.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -58.79 156.25 25.97 Favored Pre-proline 0 CA--C 1.554 1.129 0 C-N-CA 124.906 1.282 . . . . 0.0 113.2 173.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -68.23 171.87 12.01 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 123.956 3.104 . . . . 0.0 114.345 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -139.29 -179.99 6.2 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.331 1.852 . . . . 0.0 112.954 -171.153 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 -137.86 4.07 2.51 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.707 1.603 . . . . 0.0 114.57 -177.29 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -61.49 -15.44 37.82 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.137 1.375 . . . . 0.0 114.346 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -106.42 14.91 26.67 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.263 2.225 . . . . 0.0 113.236 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 30.4 t -120.89 143.97 31.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.824 1.249 . . . . 0.0 111.008 -176.434 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 88.9 mt -117.0 164.52 14.59 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.122 2.169 . . . . 0.0 111.124 177.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -123.04 139.31 54.2 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.734 2.014 . . . . 0.0 107.523 167.401 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.31 140.95 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 124.723 1.209 . . . . 0.0 109.792 -169.211 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 5.0 m -132.54 133.75 44.12 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.119 1.368 . . . . 0.0 109.735 -177.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -158.98 157.86 28.51 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 124.156 0.982 . . . . 0.0 112.332 -169.388 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.49 146.28 43.06 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.876 3.051 . . . . 0.0 113.465 170.26 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -53.86 -25.2 18.63 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -62.53 -18.9 62.97 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.211 1.804 . . . . 0.0 114.381 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 17.2 m95 -69.42 157.02 37.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.568 1.147 . . . . 0.0 112.961 176.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -129.38 167.52 17.64 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.16 1.784 . . . . 0.0 111.123 173.498 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.2 m -51.98 -33.08 36.35 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.113 1.365 . . . . 0.0 111.901 170.392 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 70.3 m -64.26 -43.3 95.29 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 174.003 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -66.45 -31.5 72.29 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.536 -0.728 . . . . 0.0 111.231 174.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.0 mt -70.9 -42.91 69.33 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.796 0.838 . . . . 0.0 111.428 175.31 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -60.89 -40.98 95.13 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.99 -1.069 . . . . 0.0 111.797 169.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -60.55 -33.3 72.48 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.613 1.097 . . . . 0.0 112.714 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.8 tp -76.23 -30.18 57.82 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.858 1.263 . . . . 0.0 113.86 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -123.65 -13.11 7.56 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 116.662 2.097 . . . . 0.0 116.662 -169.051 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 32.3 t -58.08 -22.19 49.38 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.327 1.421 . . . . 0.0 113.635 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -54.77 -25.83 30.44 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 171.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -86.94 -18.73 30.07 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 177.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 140.22 -159.61 26.19 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.5 1.048 . . . . 0.0 113.496 -179.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -74.77 62.72 1.1 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.401 1.48 . . . . 0.0 112.281 172.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 1.2 pp -59.08 168.55 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 126.862 2.065 . . . . 0.0 113.497 178.617 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -130.74 150.59 51.85 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.934 1.294 . . . . 0.0 110.648 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 61.5 mt -130.97 133.19 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.217 1.407 . . . . 0.0 109.077 -174.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 45.9 m -134.94 98.21 3.95 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.387 1.475 . . . . 0.0 111.135 -177.5 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -57.84 148.52 25.04 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.778 1.231 . . . . 0.0 113.942 178.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 33.0 pt -135.36 -19.26 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.059 1.343 . . . . 0.0 113.872 170.749 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -152.88 176.93 11.3 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.776 1.231 . . . . 0.0 111.597 172.599 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -64.95 -12.54 50.84 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.895 1.678 . . . . 0.0 113.51 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.7 p -136.97 5.56 2.82 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.225 2.21 . . . . 0.0 113.234 -173.768 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 75.2 m -146.38 138.59 25.05 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.421 1.088 . . . . 0.0 113.156 -172.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.76 157.79 41.34 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.679 1.192 . . . . 0.0 112.398 176.757 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -89.9 154.84 19.55 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.755 0.822 . . . . 0.0 110.027 167.255 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.4 t -137.67 124.3 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.359 1.064 . . . . 0.0 110.15 175.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 7.5 t -93.8 132.71 37.93 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.785 1.234 . . . . 0.0 110.751 177.182 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 50.4 mt -111.85 161.1 16.72 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.352 1.461 . . . . 0.0 111.129 178.265 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 38.5 m -67.79 -25.92 65.83 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -174.143 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -145.55 153.98 52.0 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.187 1.395 . . . . 0.0 111.963 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.17 -20.85 32.36 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.23 2.62 . . . . 0.0 113.632 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -63.17 -35.3 79.83 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.79 -1.194 . . . . 0.0 111.818 171.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -69.35 -28.14 65.95 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.267 -0.896 . . . . 0.0 112.734 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.4 -43.68 98.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.586 0.754 . . . . 0.0 111.151 170.471 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 22.4 tm0? -61.39 -41.62 97.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.75 0.705 . . . . 0.0 111.588 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 95.8 mt -62.19 -47.79 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.368 0.667 . . . . 0.0 111.003 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.79 87.74 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.179 0.9 . . . . 0.0 113.383 178.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.23 -27.6 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.181 0.993 . . . . 0.0 112.117 173.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -74.53 -46.85 36.43 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 120.935 -1.103 . . . . 0.0 112.144 169.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 57.4 p -74.34 -21.23 59.79 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -174.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 84.8 p -59.49 -23.15 62.53 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -59.67 -17.75 36.57 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.198 1.399 . . . . 0.0 114.102 173.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -100.49 -0.48 37.83 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.961 1.305 . . . . 0.0 113.618 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -67.11 155.59 38.34 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.012 0.925 . . . . 0.0 112.943 176.754 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -138.22 -4.22 1.71 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.218 1.407 . . . . 0.0 112.7 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 70.7 p -141.75 5.54 1.78 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.902 1.681 . . . . 0.0 114.1 -172.893 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -156.68 169.33 24.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.273 1.829 . . . . 0.0 111.055 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 -141.1 149.33 41.44 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.147 2.179 . . . . 0.0 110.411 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 86.8 mt -137.65 142.82 35.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.633 1.573 . . . . 0.0 110.098 -177.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -144.22 164.48 30.6 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.51 1.924 . . . . 0.0 109.566 168.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 20.3 p -71.0 162.05 30.08 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 120.374 -1.454 . . . . 0.0 111.775 174.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -58.17 -36.97 73.81 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.265 -0.897 . . . . 0.0 111.834 169.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.73 92.22 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 123.643 0.777 . . . . 0.0 113.068 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.7 -39.75 95.08 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.379 -0.826 . . . . 0.0 112.029 173.428 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -65.41 -45.43 83.99 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 122.941 0.496 . . . . 0.0 112.067 172.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 6.7 t -57.43 -43.15 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.748 1.219 . . . . 0.0 112.615 176.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -61.9 -27.23 68.26 Favored Glycine 0 CA--C 1.539 1.567 0 CA-C-N 118.244 0.475 . . . . 0.0 113.604 177.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -84.64 -34.32 23.1 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.452 1.501 . . . . 0.0 112.509 172.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -56.81 -25.79 56.57 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 126.337 1.855 . . . . 0.0 113.753 175.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -51.34 -21.21 2.08 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.605 1.562 . . . . 0.0 115.016 176.14 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -59.07 -17.35 25.1 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 115.243 1.572 . . . . 0.0 115.243 170.311 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -151.38 42.72 0.71 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.705 1.621 . . . . 0.0 113.287 -174.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.42 5.51 10.16 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.787 1.635 . . . . 0.0 113.591 -172.516 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -109.31 -7.95 15.16 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.24 1.416 . . . . 0.0 113.337 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 19.4 m -144.28 163.04 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 126.447 1.899 . . . . 0.0 111.234 -177.81 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -67.68 -29.96 69.37 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.077 0.951 . . . . 0.0 113.367 175.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 25.5 m -63.74 138.81 58.64 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.206 1.402 . . . . 0.0 112.902 -179.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 148.08 -55.05 0.51 Allowed Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.613 1.101 . . . . 0.0 114.232 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -55.11 153.03 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 124.307 3.338 . . . . 0.0 115.003 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 67.5 p -70.54 -8.28 50.2 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 178.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 61.3 p -67.75 -12.66 61.03 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.102 0 C-N-CA 125.092 1.329 . . . . 0.0 113.056 177.98 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.804 0 O5'-C5'-C4' 113.861 2.615 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.497 0 N-CA-C 112.022 -0.431 . . . . 0.0 112.022 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 19.8 m -63.42 -19.52 64.76 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 -173.639 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 22.6 m -136.78 7.79 3.0 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.984 1.313 . . . . 0.0 114.014 -173.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 169.64 178.0 40.49 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 124.155 0.883 . . . . 0.0 114.287 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 80.7 p -138.41 2.33 2.25 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.43 1.492 . . . . 0.0 114.565 -175.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 2.7 t -143.04 21.97 1.92 Allowed 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.477 1.511 . . . . 0.0 112.586 -178.037 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -174.24 172.08 45.06 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.861 1.696 . . . . 0.0 112.513 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 166.07 -167.28 39.19 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 123.819 0.723 . . . . 0.0 114.155 -174.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -68.45 177.02 5.02 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 124.021 3.148 . . . . 0.0 112.573 173.389 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 22.7 t70 57.89 23.97 10.38 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 126.11 1.764 . . . . 0.0 114.494 -174.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 96.4 mt -127.16 6.23 6.46 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.555 1.942 . . . . 0.0 112.773 177.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 37.48 65.4 2.6 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 127.35 2.26 . . . . 0.0 114.495 -174.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -53.15 -23.58 23.01 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 124.33 3.353 . . . . 0.0 116.449 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -137.29 142.95 41.92 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.151 1.78 . . . . 0.0 110.894 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 69.2 mtt85 -138.92 14.36 2.67 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 126.054 1.742 . . . . 0.0 113.523 174.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.79 -19.75 64.33 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 121.029 -1.044 . . . . 0.0 113.327 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 38.4 p-80 -94.66 12.71 26.76 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.546 2.338 . . . . 0.0 113.795 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 29.3 t -120.11 141.96 37.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.108 1.363 . . . . 0.0 111.656 -171.305 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 65.7 mt -117.13 166.68 11.94 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 127.388 2.275 . . . . 0.0 110.975 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -123.92 142.24 51.32 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 126.779 2.031 . . . . 0.0 107.883 167.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.3 t -134.74 138.6 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 124.999 1.319 . . . . 0.0 109.024 -171.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 3.7 m -125.44 135.79 52.71 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.828 1.251 . . . . 0.0 109.621 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -155.49 153.35 26.36 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 124.689 1.196 . . . . 0.0 112.059 -169.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -52.42 147.51 29.13 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.818 3.012 . . . . 0.0 113.209 169.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -57.95 -18.7 25.14 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.367 1.618 . . . . 0.0 115.367 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -81.27 -15.74 54.64 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.561 1.544 . . . . 0.0 114.0 178.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 6.6 m95 -61.43 151.38 32.72 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.224 0.92 . . . . 0.0 112.323 175.118 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -119.1 165.32 14.31 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.005 1.722 . . . . 0.0 111.869 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.7 m -51.77 -34.57 40.22 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.991 1.316 . . . . 0.0 111.509 168.06 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.8 m -65.99 -41.73 90.7 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 175.405 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -64.98 -31.39 72.6 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.599 -0.688 . . . . 0.0 111.183 173.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 72.8 mt -70.5 -47.41 60.65 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.653 0.781 . . . . 0.0 111.359 174.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -59.91 -32.04 70.38 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.93 -1.106 . . . . 0.0 113.064 171.286 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -69.86 -42.67 73.22 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.148 0.886 . . . . 0.0 112.113 172.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 55.6 tp -62.11 -33.57 74.69 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.162 1.385 . . . . 0.0 112.253 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -108.28 12.91 26.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.663 1.185 . . . . 0.0 113.536 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 23.2 t -56.3 -30.32 62.37 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.026 1.33 . . . . 0.0 113.281 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.64 -14.81 9.25 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.637 1.575 . . . . 0.0 115.081 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -111.26 -4.71 14.86 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.9 1.28 . . . . 0.0 113.684 -175.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 72.86 -31.07 0.75 Allowed Glycine 0 CA--C 1.539 1.556 0 C-N-CA 126.425 1.964 . . . . 0.0 117.196 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -148.07 129.23 14.6 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.862 1.665 . . . . 0.0 110.624 -176.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.8 pt -146.07 173.5 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.556 1.542 . . . . 0.0 112.089 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -142.0 144.5 33.7 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.298 1.439 . . . . 0.0 108.59 167.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 49.7 mt -127.42 133.7 67.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.192 0.997 . . . . 0.0 109.993 -172.057 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 70.6 m -136.9 103.25 5.11 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.551 1.541 . . . . 0.0 110.529 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -60.73 158.85 11.93 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.768 1.227 . . . . 0.0 114.249 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.8 -28.68 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.694 1.197 . . . . 0.0 112.252 171.427 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -154.1 -178.5 7.14 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.878 1.271 . . . . 0.0 111.471 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.74 -19.68 62.7 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.892 1.277 . . . . 0.0 113.065 171.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.8 p -132.31 5.64 4.11 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.99 2.116 . . . . 0.0 113.525 -169.502 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 18.9 m -144.08 139.88 29.17 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.667 1.187 . . . . 0.0 113.126 -175.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.13 155.2 38.42 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.241 1.416 . . . . 0.0 112.074 174.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -89.4 149.74 22.85 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.421 1.088 . . . . 0.0 109.67 167.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 58.2 t -137.3 115.52 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.281 1.032 . . . . 0.0 110.314 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 67.9 m -80.6 142.51 33.98 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.489 1.116 . . . . 0.0 110.838 170.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 68.6 mt -119.76 160.73 22.02 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.118 1.367 . . . . 0.0 110.843 172.517 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 65.4 m -61.57 -27.45 68.64 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.049 1.5 . . . . 0.0 115.049 -175.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -144.37 152.65 54.27 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.139 1.376 . . . . 0.0 111.573 176.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.24 -12.83 36.22 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.891 3.06 . . . . 0.0 114.032 172.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.5 -38.84 88.12 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.749 -1.219 . . . . 0.0 111.683 169.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -74.62 -25.33 59.16 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.637 0.775 . . . . 0.0 112.788 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.85 -44.15 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.437 1.495 . . . . 0.0 111.179 171.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -65.41 -36.18 83.17 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.014 0.925 . . . . 0.0 112.045 178.731 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 61.3 mt -64.72 -47.92 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.316 1.047 . . . . 0.0 110.49 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.38 -34.85 79.12 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.8 -41.14 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 O-C-N 121.058 -1.027 . . . . 0.0 111.11 170.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -62.66 -42.58 99.69 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -72.96 -31.38 64.52 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.739 0.816 . . . . 0.0 113.028 -178.209 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 10.3 t -65.04 -16.39 63.39 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 174.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -55.29 -21.88 16.4 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.383 1.473 . . . . 0.0 114.001 176.734 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -124.79 16.41 8.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.78 1.632 . . . . 0.0 112.994 -175.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.22 159.47 17.65 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.293 1.037 . . . . 0.0 113.113 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -135.8 -8.92 2.12 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.027 1.331 . . . . 0.0 113.098 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 71.4 p -140.54 2.43 1.82 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.497 1.519 . . . . 0.0 114.432 -172.22 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -157.49 176.07 13.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.438 1.895 . . . . 0.0 110.794 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -147.55 147.21 29.86 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.309 1.444 . . . . 0.0 110.827 169.503 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 76.0 mt -129.77 142.05 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 126.237 1.815 . . . . 0.0 109.694 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -146.55 163.14 36.71 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.789 1.636 . . . . 0.0 110.79 170.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 19.2 p -71.1 164.97 24.53 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 120.644 -1.285 . . . . 0.0 112.192 173.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -58.61 -39.4 80.35 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 121.038 -1.039 . . . . 0.0 111.983 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.8 -34.29 78.0 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.802 0.841 . . . . 0.0 113.195 177.344 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -71.84 -40.66 68.91 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.349 -0.845 . . . . 0.0 112.142 170.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -60.71 -36.33 78.53 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.954 1.302 . . . . 0.0 113.559 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 3.2 t -46.4 -37.93 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 125.206 1.402 . . . . 0.0 113.749 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -69.13 -9.09 59.69 Favored Glycine 0 CA--C 1.543 1.821 0 N-CA-C 115.376 0.91 . . . . 0.0 115.376 178.547 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 5.8 mptt -124.74 5.3 8.14 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.904 2.481 . . . . 0.0 113.127 178.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -62.64 -30.98 71.77 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.205 1.802 . . . . 0.0 114.386 -173.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -69.26 157.35 37.13 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.407 1.083 . . . . 0.0 112.806 173.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -138.26 164.79 28.34 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.669 1.588 . . . . 0.0 111.549 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -136.88 23.36 3.22 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.303 1.43 . . . . 0.0 114.429 -175.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -130.61 18.59 5.22 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 126.37 1.868 . . . . 0.0 112.721 -176.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -146.53 130.37 17.14 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.458 1.903 . . . . 0.0 109.83 -176.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 27.6 m -70.05 149.98 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.005 0.922 . . . . 0.0 112.066 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -78.43 -11.32 59.94 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.721 1.208 . . . . 0.0 113.949 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 16.3 m -60.52 160.91 8.22 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.244 1.818 . . . . 0.0 113.497 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -169.89 172.53 43.81 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 124.209 0.909 . . . . 0.0 114.194 176.495 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -79.71 -0.71 10.92 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.774 3.649 . . . . 0.0 114.778 -173.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 58.8 p -65.26 -13.6 58.75 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 91.0 p -150.51 166.89 28.81 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.427 1.491 . . . . 0.0 112.612 175.667 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.229 0 C-N-CA 125.235 1.398 . . . . 0.0 112.816 179.606 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . 0.429 ' H81' " O4'" ' A' ' 524' ' ' GDP . . . . . . . . 0 O4'--C4' 1.419 -2.84 0 C5'-C4'-O4' 113.118 2.798 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 524' ' ' GDP . . . . . 0.429 " O4'" ' H81' ' A' ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.45 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 80.7 p -69.95 168.77 14.63 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.87 1.268 . . . . 0.0 113.514 175.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 25.0 m -132.19 4.15 4.04 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.925 1.29 . . . . 0.0 114.133 -177.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -179.76 24.62 0.04 OUTLIER Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.307 0.956 . . . . 0.0 115.213 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 34.3 p -64.86 -12.71 51.56 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.209 1.559 . . . . 0.0 115.209 -174.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 89.6 p -64.69 -26.11 68.24 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.524 1.129 . . . . 0.0 113.681 170.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 61.36 18.27 55.12 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.796 1.189 . . . . 0.0 114.63 -173.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -178.15 68.47 0.08 OUTLIER Glycine 0 CA--C 1.536 1.361 0 CA-C-N 118.288 1.044 . . . . 0.0 113.569 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.31 -24.76 31.39 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.371 2.714 . . . . 0.0 113.668 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -72.71 140.77 48.05 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.368 1.067 . . . . 0.0 111.626 171.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 95.9 mt -130.57 3.78 4.61 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.692 1.597 . . . . 0.0 113.445 -176.381 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -66.99 158.8 79.75 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 123.83 0.852 . . . . 0.0 112.134 172.675 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -51.23 144.25 30.57 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.725 2.95 . . . . 0.0 113.509 172.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? -82.47 -41.25 20.03 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -176.513 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -141.23 -12.25 0.93 Allowed 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 126.523 1.929 . . . . 0.0 114.89 -172.777 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.9 -17.75 64.87 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -173.609 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 38.1 p-80 -100.17 14.41 30.9 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.434 2.294 . . . . 0.0 113.352 176.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 23.4 t -120.54 133.28 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.665 1.186 . . . . 0.0 111.649 -170.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 94.1 mt -103.81 166.63 10.29 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.842 2.057 . . . . 0.0 111.669 175.691 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -125.32 138.75 54.07 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 127.371 2.268 . . . . 0.0 107.413 167.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.2 t -135.61 138.64 47.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 C-N-CA 124.822 1.249 . . . . 0.0 109.165 -170.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 6.9 m -126.62 131.25 51.52 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.919 1.288 . . . . 0.0 109.23 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -150.51 160.37 32.93 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.678 1.191 . . . . 0.0 112.925 -168.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -54.13 156.59 12.76 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 124.658 3.572 . . . . 0.0 115.32 177.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -58.01 -12.64 3.52 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.396 1.878 . . . . 0.0 115.913 174.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -117.63 -1.03 11.71 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.791 1.636 . . . . 0.0 113.848 -177.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 1.7 m0 -66.81 154.28 41.25 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.223 -0.923 . . . . 0.0 111.874 169.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -129.54 166.47 19.61 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.097 1.359 . . . . 0.0 113.278 -174.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.3 m -47.29 -33.38 5.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.909 1.684 . . . . 0.0 112.865 170.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 20.2 p -72.9 -41.06 65.0 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -60.49 -28.23 68.2 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.551 0.614 . . . . 0.0 110.33 168.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.2 mt -78.36 -46.2 20.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.544 0.338 . . . . 0.0 111.782 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -58.11 -39.64 79.15 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.055 -1.028 . . . . 0.0 111.989 169.676 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -64.37 -34.45 78.18 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.166 0.893 . . . . 0.0 112.869 174.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 44.1 tp -71.52 -28.9 64.21 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.172 0.989 . . . . 0.0 113.141 177.455 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -121.7 3.85 10.08 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 -172.164 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 75.3 p -56.77 -24.57 51.22 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.12 -15.06 8.17 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.568 1.547 . . . . 0.0 114.624 173.437 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -106.15 3.55 28.09 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.342 1.457 . . . . 0.0 113.861 -177.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 82.55 -45.44 3.38 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.879 1.704 . . . . 0.0 115.572 169.203 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -150.85 143.91 24.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.935 1.294 . . . . 0.0 111.127 177.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 24.1 pt -144.78 171.42 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 125.209 1.404 . . . . 0.0 112.076 -175.583 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -138.33 105.68 5.52 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.244 1.018 . . . . 0.0 109.521 167.197 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.9 mt -74.53 135.72 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.094 0.958 . . . . 0.0 108.477 172.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.7 m -138.99 96.71 3.16 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.503 1.921 . . . . 0.0 109.523 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -58.18 155.94 10.51 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -173.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 8.5 mt -131.72 -41.1 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.177 1.391 . . . . 0.0 110.054 176.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -156.49 179.89 8.83 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.443 1.497 . . . . 0.0 111.441 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -56.23 -20.26 17.52 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.619 1.968 . . . . 0.0 114.087 173.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.6 p -131.42 4.02 4.29 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.273 1.829 . . . . 0.0 113.778 -173.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 69.5 m -144.4 139.42 28.4 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.12 0.968 . . . . 0.0 112.894 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -149.88 152.02 34.39 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.669 1.188 . . . . 0.0 112.24 175.478 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -89.42 151.73 21.87 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.829 0.852 . . . . 0.0 108.788 167.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 49.3 t -140.51 111.14 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.867 0.867 . . . . 0.0 110.591 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 72.4 m -73.84 143.71 45.8 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.796 0.838 . . . . 0.0 110.629 169.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 67.3 mt -118.81 164.63 15.12 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.701 1.6 . . . . 0.0 110.516 171.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 63.3 m -62.71 -28.86 70.24 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -144.35 152.75 54.6 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 124.701 1.2 . . . . 0.0 112.346 -177.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.94 -16.67 32.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.457 2.771 . . . . 0.0 113.807 173.434 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.41 -38.48 90.05 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.946 -1.096 . . . . 0.0 111.813 170.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -67.13 -31.04 71.22 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.259 1.024 . . . . 0.0 112.338 179.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 43.4 t -58.28 -40.04 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.986 0.914 . . . . 0.0 111.283 171.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -65.77 -38.37 88.87 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.62 -0.675 . . . . 0.0 111.683 178.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 78.8 mt -65.3 -44.51 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.236 1.014 . . . . 0.0 110.669 175.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.21 -41.14 99.1 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.324 -0.86 . . . . 0.0 112.868 176.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 57.8 t -67.52 -31.56 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.147 0.979 . . . . 0.0 112.303 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -69.4 -49.73 52.61 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.028 -1.045 . . . . 0.0 111.854 171.139 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 23.7 p -71.37 -24.46 62.09 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -174.185 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 60.1 p -67.1 -14.29 62.76 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 176.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -59.88 -16.14 26.88 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.81 1.244 . . . . 0.0 113.734 169.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -119.17 10.95 12.21 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.628 1.571 . . . . 0.0 112.777 -172.128 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.68 164.24 10.13 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.97 1.308 . . . . 0.0 112.657 170.052 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -136.53 -27.95 1.03 Allowed 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -177.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 42.9 m -133.4 5.65 3.77 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.673 1.189 . . . . 0.0 113.856 -175.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -150.41 176.16 11.18 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.581 1.952 . . . . 0.0 110.468 -176.315 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -144.27 150.77 38.43 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.547 1.139 . . . . 0.0 111.397 173.179 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 34.2 mt -133.87 140.1 47.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.345 1.858 . . . . 0.0 108.541 177.572 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -149.65 172.43 15.06 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.101 1.76 . . . . 0.0 110.319 174.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 32.3 p -72.61 163.14 28.54 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.715 -1.241 . . . . 0.0 111.959 171.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -54.54 -41.66 70.02 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.267 -0.896 . . . . 0.0 111.848 169.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.76 -35.76 80.85 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.68 -33.2 73.56 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.024 -1.048 . . . . 0.0 112.926 175.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -67.0 -46.99 72.88 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.721 -0.612 . . . . 0.0 111.813 170.46 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 24.6 t -59.7 -41.51 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.381 1.072 . . . . 0.0 112.365 174.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -66.66 -38.65 93.39 Favored Glycine 0 CA--C 1.534 1.238 0 O-C-N 121.486 -0.759 . . . . 0.0 113.956 -172.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -16.83 58.13 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 174.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -56.17 -28.71 59.12 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.345 1.458 . . . . 0.0 113.291 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -69.01 -12.43 61.68 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.572 1.549 . . . . 0.0 114.509 174.504 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -127.29 -30.65 2.62 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.642 1.577 . . . . 0.0 113.75 -175.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 110.18 -169.52 13.6 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 125.148 1.356 . . . . 0.0 114.252 174.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -60.69 159.12 11.35 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 125.041 1.336 . . . . 0.0 112.423 173.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -126.78 -7.0 6.17 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.692 1.197 . . . . 0.0 113.956 -176.518 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.5 m -78.7 -15.16 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 124.631 1.172 . . . . 0.0 113.65 175.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -153.31 171.74 18.1 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.895 2.078 . . . . 0.0 111.53 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 44.9 p -150.67 -51.73 0.13 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.329 1.052 . . . . 0.0 112.958 175.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 65.15 -173.73 18.32 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 124.545 1.069 . . . . 0.0 114.859 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -71.88 165.73 31.68 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.771 2.981 . . . . 0.0 112.438 174.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 68.4 m -140.78 149.26 41.85 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.202 1.401 . . . . 0.0 111.871 -178.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 22.8 m -71.81 -16.0 62.16 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -178.028 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.199 0 C-N-CA 125.738 1.637 . . . . 0.0 113.0 -178.554 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . 0.401 ' H81' " O4'" ' A' ' 524' ' ' GDP . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 C5'-C4'-O4' 111.8 1.857 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 524' ' ' GDP . . . . . 0.401 " O4'" ' H81' ' A' ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.65 0 N-CA-C 111.822 -0.511 . . . . 0.0 111.822 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 78.6 p -137.15 -7.73 1.79 Allowed 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -173.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 28.3 p -69.46 -29.94 67.73 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.695 1.198 . . . . 0.0 113.518 174.206 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 153.87 178.71 28.61 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 126.037 1.779 . . . . 0.0 112.508 177.27 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 25.4 m -59.33 -22.36 61.15 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.18 0.992 . . . . 0.0 113.617 175.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 14.6 m -66.94 -10.57 50.49 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.526 1.93 . . . . 0.0 114.685 173.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -69.84 46.36 0.57 Allowed Glycine 0 CA--C 1.538 1.476 0 C-N-CA 127.588 2.518 . . . . 0.0 116.234 -175.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 169.46 -56.55 0.2 Allowed Glycine 0 CA--C 1.54 1.634 0 C-N-CA 126.265 1.888 . . . . 0.0 113.185 -176.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -80.09 -2.49 12.1 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.593 2.862 . . . . 0.0 114.823 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -140.14 168.25 20.26 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.482 1.113 . . . . 0.0 112.651 -177.636 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 85.5 mt -88.77 156.92 18.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.696 1.598 . . . . 0.0 113.157 -172.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 35.09 52.58 1.49 Allowed Pre-proline 0 CA--C 1.554 1.13 0 C-N-CA 127.713 2.405 . . . . 0.0 116.155 -178.369 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -54.3 -31.32 66.55 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 122.928 2.418 . . . . 0.0 114.535 -177.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -71.28 -3.77 22.27 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.729 2.012 . . . . 0.0 115.813 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 -133.34 -18.73 2.22 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 125.778 1.631 . . . . 0.0 113.844 175.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -63.04 -14.29 46.28 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 177.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -93.62 7.7 43.7 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.701 1.6 . . . . 0.0 114.0 173.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 19.0 t -117.64 139.07 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.711 1.204 . . . . 0.0 111.772 -170.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.7 mt -113.15 166.3 11.57 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.711 2.004 . . . . 0.0 111.537 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -127.72 140.9 51.78 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.526 2.331 . . . . 0.0 107.88 168.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.2 t -136.18 141.04 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.959 1.304 . . . . 0.0 109.498 -169.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 6.7 m -134.14 136.14 43.62 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.724 1.209 . . . . 0.0 109.848 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.7 p90 -158.86 159.04 29.59 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.277 1.031 . . . . 0.0 112.679 -169.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -52.6 147.53 30.27 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 124.225 3.284 . . . . 0.0 114.069 171.319 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -60.72 -12.74 11.41 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 115.854 1.798 . . . . 0.0 115.854 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -75.11 -17.59 60.4 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.879 1.272 . . . . 0.0 113.953 176.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -65.39 154.77 37.43 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -178.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -119.79 164.81 15.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 127.044 2.138 . . . . 0.0 111.697 173.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.6 m -55.81 -31.64 62.85 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.163 0.985 . . . . 0.0 110.908 168.039 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.0 m -64.53 -40.85 96.37 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 172.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -66.49 -30.24 70.53 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.613 -0.679 . . . . 0.0 111.202 173.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 49.7 mt -70.5 -44.81 66.86 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.354 0.662 . . . . 0.0 111.542 173.478 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -57.73 -39.61 77.71 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 120.993 -1.067 . . . . 0.0 111.962 169.531 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 64.3 tp60 -67.82 -33.18 74.28 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.075 0.852 . . . . 0.0 113.257 175.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.5 tp -69.87 -32.02 70.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.467 1.107 . . . . 0.0 112.725 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -115.96 6.02 14.08 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -172.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 79.2 p -58.54 -23.85 59.24 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.941 1.297 . . . . 0.0 114.349 175.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.23 -13.09 4.33 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.622 1.569 . . . . 0.0 114.38 172.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -114.21 5.23 15.8 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.847 1.659 . . . . 0.0 113.304 -176.721 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 72.02 -122.57 9.08 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.473 1.035 . . . . 0.0 112.576 177.493 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -60.64 128.48 36.81 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.412 1.085 . . . . 0.0 111.862 173.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 28.4 pt -142.67 167.52 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.807 1.643 . . . . 0.0 110.894 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -137.98 99.51 3.91 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.155 1.382 . . . . 0.0 110.537 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 56.3 mt -79.74 143.2 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.612 1.565 . . . . 0.0 109.644 177.265 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 7.9 t -141.14 111.61 6.89 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.937 1.295 . . . . 0.0 111.399 175.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -62.39 154.2 28.91 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 7.3 mt -132.68 -44.34 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.982 1.313 . . . . 0.0 110.115 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -153.03 177.38 10.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.326 1.85 . . . . 0.0 109.416 170.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.26 1.13 2.3 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -174.784 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 69.1 p -138.09 5.29 2.54 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 127.259 2.224 . . . . 0.0 113.199 -175.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 88.2 p -154.2 149.36 26.94 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.39 152.48 33.16 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.109 1.364 . . . . 0.0 111.919 -176.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -89.42 153.96 20.43 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 166.739 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 40.6 t -139.54 109.73 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.548 0.739 . . . . 0.0 110.081 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 24.7 m -77.33 132.76 38.75 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.358 1.063 . . . . 0.0 109.53 168.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 77.0 mt -112.35 158.59 19.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.997 1.319 . . . . 0.0 110.516 176.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 58.5 m -68.12 -21.5 64.94 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -174.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -143.28 150.75 52.99 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 124.896 1.278 . . . . 0.0 111.751 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.74 -16.54 37.7 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.463 2.775 . . . . 0.0 113.747 175.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -65.58 -36.51 83.98 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.038 -1.039 . . . . 0.0 112.161 171.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -69.35 -31.88 70.6 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.456 1.102 . . . . 0.0 112.073 -178.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.01 -42.01 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.806 1.242 . . . . 0.0 111.462 171.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 52.8 mm-40 -64.52 -39.17 93.29 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.886 -0.509 . . . . 0.0 111.697 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.98 -48.29 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 124.218 1.007 . . . . 0.0 110.507 177.328 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.52 -36.97 85.54 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.4 t -64.55 -40.14 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 121.188 -0.945 . . . . 0.0 111.194 171.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -63.48 -47.66 80.86 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.774 0.715 . . . . 0.0 112.58 175.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.7 p -69.54 -29.51 67.12 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -175.408 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 11.1 t -62.61 -18.81 62.94 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -60.29 -16.55 35.37 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -123.53 8.17 8.95 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.765 1.626 . . . . 0.0 112.724 -173.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -66.84 155.29 38.7 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.107 1.363 . . . . 0.0 112.74 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -133.61 -9.56 2.81 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.681 1.193 . . . . 0.0 113.994 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 40.4 m -136.87 6.51 2.91 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.205 1.402 . . . . 0.0 113.588 -175.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -160.97 171.84 17.97 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.539 1.936 . . . . 0.0 110.576 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -141.61 151.21 42.92 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.425 1.89 . . . . 0.0 110.451 169.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 62.0 mt -132.7 142.8 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 126.189 1.796 . . . . 0.0 109.6 -179.187 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -144.6 164.47 30.84 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.02 1.728 . . . . 0.0 110.02 169.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 32.6 p -72.0 164.78 25.51 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 120.604 -1.31 . . . . 0.0 112.065 172.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -59.27 -39.37 82.66 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.943 -1.098 . . . . 0.0 112.095 169.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -63.6 -36.91 85.35 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.64 0.776 . . . . 0.0 112.845 176.126 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -66.23 -47.14 74.8 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.424 -0.798 . . . . 0.0 111.854 169.757 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -53.26 -43.02 67.08 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.687 0.676 . . . . 0.0 112.378 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 24.5 t -54.13 -35.04 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.546 1.139 . . . . 0.0 113.195 175.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -90.3 -35.78 7.35 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 123.812 0.72 . . . . 0.0 113.698 179.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -76.1 -1.51 26.37 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.825 1.65 . . . . 0.0 113.921 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 57.5 tttm -56.57 -31.75 64.51 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 126.886 2.074 . . . . 0.0 115.196 -172.013 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 55.44 -179.27 0.04 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.881 2.073 . . . . 0.0 115.041 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -89.88 -7.41 54.3 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.573 1.549 . . . . 0.0 114.836 -170.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 80.7 -169.4 52.22 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 124.298 0.951 . . . . 0.0 114.076 -177.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -144.58 141.22 29.29 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.914 1.685 . . . . 0.0 111.177 -176.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.6 mp0 -68.62 147.97 51.15 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.333 1.453 . . . . 0.0 112.294 178.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 40.8 t -135.51 -26.66 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 125.007 1.323 . . . . 0.0 112.599 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -145.96 170.13 17.22 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 126.066 1.746 . . . . 0.0 112.319 -177.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 60.7 p -63.71 -24.09 67.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 -176.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 178.01 171.61 41.59 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 124.622 1.106 . . . . 0.0 113.583 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.37 -26.65 14.16 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.47 2.78 . . . . 0.0 113.627 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 35.5 m 52.34 30.37 7.99 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 126.393 1.877 . . . . 0.0 115.055 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 90.6 p -137.77 3.36 2.48 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.403 1.481 . . . . 0.0 114.643 -174.758 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.252 0 C-N-CA 125.451 1.5 . . . . 0.0 112.943 -178.889 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.698 0 C4'-C3'-O3' 114.235 1.398 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.508 0 N-CA-C 111.956 -0.458 . . . . 0.0 111.956 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 7.6 t -150.97 173.24 14.53 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.087 1.355 . . . . 0.0 111.984 179.064 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 20.7 t -60.66 138.45 58.07 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.034 0.934 . . . . 0.0 111.654 174.38 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 86.93 -18.64 34.36 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.909 1.243 . . . . 0.0 114.955 -178.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 21.6 m -69.39 -18.6 63.78 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.824 1.312 . . . . 0.0 113.808 175.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 56.4 m -144.93 166.45 25.24 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.551 1.941 . . . . 0.0 111.417 -177.174 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -171.83 178.9 43.84 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 124.671 1.129 . . . . 0.0 113.808 178.789 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 173.62 -51.11 0.15 Allowed Glycine 0 CA--C 1.541 1.714 0 CA-C-O 118.42 -1.211 . . . . 0.0 114.594 -178.774 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -56.15 165.22 4.27 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 124.334 3.356 . . . . 0.0 114.939 173.182 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -143.37 161.91 37.11 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.462 1.505 . . . . 0.0 112.667 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 96.9 mt -142.71 169.64 17.19 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.7 2.0 . . . . 0.0 111.01 -176.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -134.95 127.22 18.17 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 125.071 1.348 . . . . 0.0 110.707 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -82.9 -17.47 6.96 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.433 2.755 . . . . 0.0 114.05 -179.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -65.11 143.96 57.55 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.286 1.435 . . . . 0.0 112.381 -176.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.1 mmt-85 -135.56 -0.81 2.6 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 125.191 1.396 . . . . 0.0 114.4 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -62.36 -23.13 66.63 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.074 0.95 . . . . 0.0 113.492 179.035 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -99.99 12.84 35.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.834 2.054 . . . . 0.0 113.227 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 38.3 t -118.96 137.28 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.746 1.218 . . . . 0.0 111.818 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 61.3 mt -117.33 166.26 12.51 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 127.121 2.168 . . . . 0.0 110.762 175.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -124.46 142.33 51.4 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 127.362 2.265 . . . . 0.0 107.935 168.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 9.2 t -134.03 138.29 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.638 1.175 . . . . 0.0 109.235 -173.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.3 m -123.09 135.16 54.27 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.858 1.263 . . . . 0.0 109.898 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -158.7 157.3 28.4 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.485 1.114 . . . . 0.0 112.512 -170.277 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.18 146.03 73.31 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.783 2.989 . . . . 0.0 112.485 168.423 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -58.44 -18.86 31.75 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 -177.258 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -64.34 -19.25 65.33 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.724 1.209 . . . . 0.0 113.913 175.003 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 16.3 m95 -67.39 162.46 22.95 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.471 1.108 . . . . 0.0 113.151 175.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -143.1 169.92 16.69 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 127.255 2.222 . . . . 0.0 110.947 178.623 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.2 m -51.45 -30.79 20.84 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.292 1.837 . . . . 0.0 112.121 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 14.4 p -74.76 -43.04 56.94 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 177.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -61.15 -26.09 67.46 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.91 -0.494 . . . . 0.0 110.702 169.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 76.1 mt -78.78 -44.51 23.07 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 122.772 0.429 . . . . 0.0 111.477 176.403 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -57.14 -37.22 71.71 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.029 -1.045 . . . . 0.0 112.143 169.262 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -68.45 -37.75 80.5 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.943 0.897 . . . . 0.0 113.058 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 59.6 tp -68.36 -28.49 67.17 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.328 1.051 . . . . 0.0 112.975 176.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -117.23 8.74 13.27 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -172.01 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 81.8 p -58.14 -27.26 63.61 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.68 -18.23 40.5 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.243 1.417 . . . . 0.0 114.63 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -94.11 0.58 55.94 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.878 1.271 . . . . 0.0 114.267 -177.098 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.97 -45.85 3.39 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.837 1.684 . . . . 0.0 115.182 169.517 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -150.55 133.83 16.27 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.927 1.291 . . . . 0.0 110.78 175.375 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 15.4 pt -143.48 171.93 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.468 1.507 . . . . 0.0 111.367 -174.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -138.77 152.14 47.68 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.723 1.609 . . . . 0.0 110.302 169.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 76.2 mt -134.08 139.64 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.082 1.353 . . . . 0.0 109.707 -169.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 7.0 t -144.42 107.24 4.46 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.047 0.939 . . . . 0.0 112.588 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -63.23 148.89 46.87 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 37.0 pt -134.8 -20.93 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.939 1.296 . . . . 0.0 113.714 171.714 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -153.19 178.77 9.38 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.842 1.257 . . . . 0.0 111.229 173.311 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -66.84 -15.46 63.63 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.59 1.156 . . . . 0.0 112.698 174.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 39.5 p -132.57 8.47 4.22 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.656 1.982 . . . . 0.0 112.976 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 3.7 m -149.34 142.67 25.18 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.564 1.146 . . . . 0.0 113.543 -177.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.29 160.47 43.79 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.514 1.526 . . . . 0.0 111.377 174.446 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -89.34 154.57 19.98 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.808 0.843 . . . . 0.0 110.116 168.425 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 60.9 t -133.8 112.23 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 124.543 1.137 . . . . 0.0 109.164 171.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 37.7 m -85.7 135.11 33.89 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.655 1.582 . . . . 0.0 109.945 172.19 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 79.4 mt -118.64 164.01 15.96 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.973 1.309 . . . . 0.0 111.458 -177.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 58.1 m -69.44 -22.36 63.67 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -177.31 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -146.75 151.32 42.11 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.185 1.394 . . . . 0.0 112.351 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.19 -19.53 33.95 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.481 2.787 . . . . 0.0 113.303 173.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -64.09 -36.27 83.46 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.601 -1.312 . . . . 0.0 111.897 169.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -68.98 -31.7 70.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.061 0.944 . . . . 0.0 112.244 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 86.8 t -57.7 -46.38 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 125.09 1.356 . . . . 0.0 110.753 172.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -63.46 -41.67 98.61 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.263 0.625 . . . . 0.0 112.223 177.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 95.6 mt -62.51 -44.04 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.925 0.89 . . . . 0.0 111.213 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -65.23 -39.45 92.74 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.074 -1.016 . . . . 0.0 113.082 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 80.6 t -65.54 -40.94 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 121.189 -0.944 . . . . 0.0 111.49 174.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -62.01 -48.11 81.78 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.353 1.061 . . . . 0.0 112.533 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 25.4 p -73.16 -27.96 61.96 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.025 0.93 . . . . 0.0 113.151 -175.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.1 t -64.65 -14.91 60.22 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 171.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -60.75 -14.38 20.9 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.686 1.194 . . . . 0.0 113.431 169.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -114.12 8.26 16.92 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.493 1.917 . . . . 0.0 112.871 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.66 160.96 21.57 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.857 1.263 . . . . 0.0 113.122 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.66 -7.82 1.1 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 32.6 m -140.89 8.73 2.12 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.135 1.374 . . . . 0.0 113.631 -178.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 55.6 p90 -160.01 173.89 15.18 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.243 1.817 . . . . 0.0 110.841 -176.402 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -147.73 143.47 27.6 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.036 1.334 . . . . 0.0 110.826 169.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 71.8 mt -120.35 137.18 54.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 126.222 1.809 . . . . 0.0 109.322 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -147.21 169.06 20.15 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.106 1.363 . . . . 0.0 111.293 174.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 43.9 p -71.73 162.66 29.1 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.945 -1.097 . . . . 0.0 112.652 176.672 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -56.28 -37.08 69.36 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.605 0.762 . . . . 0.0 112.322 169.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -68.02 -40.0 83.02 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.046 0.938 . . . . 0.0 113.152 176.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -67.77 -32.83 73.68 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.045 -1.034 . . . . 0.0 112.505 174.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -63.84 -49.86 71.13 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.064 0.946 . . . . 0.0 111.796 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 8.8 t -53.83 -40.26 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 124.356 1.063 . . . . 0.0 111.954 172.009 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -63.79 -12.36 47.41 Favored Glycine 0 CA--C 1.541 1.708 0 N-CA-C 115.88 1.112 . . . . 0.0 115.88 -178.495 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -115.1 -2.74 12.69 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -54.49 -24.37 20.2 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 125.886 1.674 . . . . 0.0 115.262 -177.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -133.41 20.43 3.98 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.812 1.645 . . . . 0.0 113.055 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -142.4 66.68 1.33 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.596 1.558 . . . . 0.0 110.92 -173.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 164.96 -17.14 0.1 OUTLIER Glycine 0 CA--C 1.537 1.414 0 N-CA-C 116.127 1.211 . . . . 0.0 116.127 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -53.09 -58.63 6.36 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.36 1.464 . . . . 0.0 113.519 -174.127 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -157.49 27.58 0.29 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.851 1.66 . . . . 0.0 111.59 175.812 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 34.4 m -60.05 -17.18 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -173.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -62.89 -22.99 67.13 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.388 1.475 . . . . 0.0 113.772 172.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 77.2 p -126.87 -22.38 3.85 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 174.201 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 101.94 -171.57 21.82 Favored Glycine 0 CA--C 1.54 1.655 0 N-CA-C 116.889 1.516 . . . . 0.0 116.889 167.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -51.81 -26.22 23.4 Favored 'Trans proline' 0 C--N 1.353 0.773 1 C-N-CA 125.604 4.203 . . . . 0.0 116.745 -175.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 72.8 p -62.63 -16.3 56.08 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 174.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 58.2 m -131.64 2.98 4.15 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.805 1.642 . . . . 0.0 113.72 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.246 0 CA-C-O 118.193 -1.337 . . . . 0.0 113.261 179.207 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 C5'-C4'-C3' 111.264 -2.824 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.404 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 50.3 m -143.8 164.59 30.06 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.226 1.41 . . . . 0.0 112.083 -174.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.4 t -149.88 160.33 43.67 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.301 1.44 . . . . 0.0 111.418 176.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 138.27 -13.49 3.52 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.209 1.385 . . . . 0.0 114.889 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 78.3 p -129.56 1.47 5.0 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.519 1.528 . . . . 0.0 114.415 -172.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 59.2 p -72.79 -12.39 60.98 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.4 1.48 . . . . 0.0 114.326 173.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -78.17 -173.31 41.38 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 125.425 1.488 . . . . 0.0 114.484 177.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -172.83 -172.34 38.4 Favored Glycine 0 CA--C 1.54 1.606 0 C-N-CA 124.881 1.229 . . . . 0.0 113.527 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -75.18 53.34 3.38 Favored 'Trans proline' 0 CA--C 1.549 1.264 1 C-N-CA 125.447 4.098 . . . . 0.0 112.909 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -60.54 157.39 14.34 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.786 1.634 . . . . 0.0 113.162 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 3.6 pp -62.71 164.64 7.49 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.749 1.22 . . . . 0.0 114.268 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -138.11 91.51 12.99 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 125.739 1.616 . . . . 0.0 109.804 -175.432 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -74.15 163.35 36.8 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.151 2.567 . . . . 0.0 112.527 -175.504 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -71.3 26.83 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 126.386 1.874 . . . . 0.0 114.843 175.105 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 78.7 mtm-85 50.35 36.85 13.89 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 126.995 2.118 . . . . 0.0 113.912 -170.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -63.95 -16.36 61.35 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.466 1.107 . . . . 0.0 113.521 174.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -89.12 11.0 19.79 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.912 2.085 . . . . 0.0 113.83 172.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 44.1 t -121.96 137.23 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 125.169 1.388 . . . . 0.0 110.734 -176.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.7 mt -98.73 162.67 12.99 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 125.871 1.668 . . . . 0.0 111.95 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -118.34 138.45 52.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 127.658 2.383 . . . . 0.0 106.287 166.335 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.8 t -136.33 139.98 44.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 124.233 1.013 . . . . 0.0 109.417 -169.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.7 m -131.24 134.04 46.05 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.18 1.392 . . . . 0.0 109.699 -178.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -157.5 158.43 30.65 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 124.273 1.029 . . . . 0.0 112.504 -169.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -55.81 144.76 75.67 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.318 2.679 . . . . 0.0 111.923 168.785 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -55.39 -24.4 29.71 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 115.316 1.598 . . . . 0.0 115.316 -176.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -63.15 -21.21 66.05 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.149 1.379 . . . . 0.0 113.782 178.008 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 13.4 m95 -63.69 152.74 38.27 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.081 0.953 . . . . 0.0 112.547 174.533 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 43.2 mttm -133.56 171.82 13.57 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.211 1.804 . . . . 0.0 111.653 176.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.1 m -50.62 -35.01 28.36 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.341 1.456 . . . . 0.0 112.338 172.13 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.5 m -65.07 -42.4 94.2 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 175.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.12 -31.45 72.32 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.623 -0.673 . . . . 0.0 111.246 174.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 78.1 mt -70.91 -44.51 66.07 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.884 0.874 . . . . 0.0 111.507 175.178 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -57.28 -41.97 80.77 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.24 -0.912 . . . . 0.0 111.938 169.412 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.25 -39.07 92.16 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 118.808 0.731 . . . . 0.0 112.947 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.0 tp -65.98 -35.05 79.53 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.618 1.167 . . . . 0.0 112.398 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -111.71 5.83 19.45 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -173.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 24.5 t -53.63 -30.64 43.77 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.399 1.479 . . . . 0.0 113.515 173.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.6 -12.15 3.79 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 125.778 1.631 . . . . 0.0 115.129 175.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -113.53 3.08 15.58 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.662 1.585 . . . . 0.0 113.534 -177.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 93.74 -151.62 20.39 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.476 1.036 . . . . 0.0 112.686 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -62.28 150.75 38.34 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.584 0.754 . . . . 0.0 112.286 170.148 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 27.4 pt -144.76 179.21 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 126.061 1.744 . . . . 0.0 111.245 -174.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -137.95 143.53 40.78 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.81 1.244 . . . . 0.0 109.338 168.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.9 mt -127.5 130.99 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.723 1.209 . . . . 0.0 109.456 -171.987 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 63.7 m -137.58 98.94 3.81 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.447 1.499 . . . . 0.0 110.993 -174.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 94.9 m95 -57.94 152.44 16.23 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.508 1.123 . . . . 0.0 113.923 179.301 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 36.5 pt -134.05 -22.31 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.778 1.231 . . . . 0.0 113.401 169.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -154.1 178.2 10.23 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.395 1.078 . . . . 0.0 111.982 174.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -66.23 -14.57 62.14 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.756 1.622 . . . . 0.0 113.189 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.2 p -132.76 8.09 4.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.261 1.824 . . . . 0.0 113.434 -175.528 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 58.0 p -156.75 151.98 26.41 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.84 162.08 41.52 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.656 1.582 . . . . 0.0 112.051 -177.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -94.61 150.58 20.09 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.13 0.972 . . . . 0.0 110.124 167.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 47.5 t -138.99 113.79 8.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.318 1.047 . . . . 0.0 110.848 177.476 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 50.9 m -76.48 136.22 39.37 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.963 1.305 . . . . 0.0 111.466 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 74.0 mt -118.57 163.92 16.07 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.582 1.553 . . . . 0.0 110.236 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 50.9 m -69.6 -23.45 63.52 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -174.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -148.19 146.39 23.13 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.752 1.221 . . . . 0.0 112.959 -176.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.69 -29.99 73.49 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.786 2.99 . . . . 0.0 114.177 168.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.0 mp0 -60.89 -37.21 81.4 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.944 -1.097 . . . . 0.0 112.073 174.191 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -70.19 -36.38 74.58 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.379 -0.826 . . . . 0.0 111.62 175.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 15.1 t -58.86 -47.84 88.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.708 0.803 . . . . 0.0 111.223 170.255 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.72 -41.33 90.6 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.519 0.599 . . . . 0.0 112.255 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 82.8 mt -62.56 -50.55 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.479 0.712 . . . . 0.0 110.983 174.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.92 -36.28 82.85 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 62.6 t -65.35 -41.0 90.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.386 -0.821 . . . . 0.0 111.048 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -64.1 -45.63 87.77 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.14 0.882 . . . . 0.0 112.814 175.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 49.1 p -72.09 -22.07 61.4 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 25.1 p -60.14 -17.33 39.67 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 175.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -52.82 -22.97 6.02 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.506 1.922 . . . . 0.0 113.717 169.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -123.9 20.51 9.2 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.993 1.717 . . . . 0.0 112.715 -175.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.79 -37.75 88.55 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 52.91 -20.68 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 130.014 3.326 . . . . 0.0 118.819 -176.274 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 51.1 m -136.2 3.63 2.88 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.4 1.48 . . . . 0.0 114.027 -173.3 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -156.42 177.72 11.14 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.103 2.161 . . . . 0.0 109.85 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -143.76 150.22 38.27 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.929 1.292 . . . . 0.0 111.022 175.582 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 92.0 mt -129.52 145.37 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.554 1.542 . . . . 0.0 110.079 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -141.16 170.19 16.19 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.799 2.44 . . . . 0.0 108.731 172.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 31.9 p -79.29 163.92 24.53 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.495 -1.378 . . . . 0.0 110.069 167.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -55.95 -43.32 77.35 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.378 -0.826 . . . . 0.0 111.678 169.214 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -67.85 -38.88 83.7 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -62.64 -38.97 92.36 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.534 1.534 . . . . 0.0 111.769 176.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -67.88 -50.8 54.3 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.318 0.647 . . . . 0.0 112.436 170.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 6.2 t -51.6 -41.5 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.885 1.274 . . . . 0.0 113.186 -177.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -64.93 -11.49 50.99 Favored Glycine 0 CA--C 1.542 1.758 0 N-CA-C 115.47 0.948 . . . . 0.0 115.47 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.1 ptpp? -137.35 11.82 3.01 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.45 1.9 . . . . 0.0 114.576 -178.863 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -49.85 -17.16 0.33 Allowed 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 118.354 2.724 . . . . 0.0 118.354 -169.356 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -60.19 -22.69 63.26 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.442 1.097 . . . . 0.0 112.666 168.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -140.42 -177.93 5.26 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 127.775 2.43 . . . . 0.0 111.102 176.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 179.7 177.96 48.18 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 121.597 -0.689 . . . . 0.0 113.975 177.169 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -61.53 151.2 33.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.94 1.296 . . . . 0.0 111.578 174.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -148.78 151.27 34.51 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.959 1.703 . . . . 0.0 109.442 171.342 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.5 m -132.95 -7.93 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 -169.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -64.6 -10.86 29.38 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 173.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 13.3 m -70.6 17.34 0.07 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.993 2.517 . . . . 0.0 116.321 -171.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -159.46 174.7 36.37 Favored Glycine 0 CA--C 1.539 1.593 0 O-C-N 120.843 -1.161 . . . . 0.0 114.122 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -72.74 164.76 34.67 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 124.137 3.225 . . . . 0.0 113.414 -175.598 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 42.8 m -134.13 9.91 3.83 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.492 1.517 . . . . 0.0 113.434 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 54.8 p -71.39 -15.48 62.37 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.376 1.47 . . . . 0.0 114.947 -178.602 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.196 0 C-N-CA 125.523 1.535 . . . . 0.0 112.722 178.75 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.612 0 C5'-C4'-O4' 112.885 2.632 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.051 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 67.4 m -143.95 157.8 44.11 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.559 1.544 . . . . 0.0 111.772 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 34.3 m -137.65 6.5 2.72 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -171.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 177.92 -177.3 48.34 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.379 0.99 . . . . 0.0 114.007 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 80.3 p -137.18 4.67 2.72 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.539 1.536 . . . . 0.0 114.368 -174.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 8.5 t -153.14 173.34 15.62 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.018 1.727 . . . . 0.0 111.083 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -170.52 174.81 44.5 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.263 0.935 . . . . 0.0 114.677 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 173.21 -175.99 45.99 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 125.859 1.695 . . . . 0.0 112.219 -177.023 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -66.31 -12.94 37.72 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.652 2.901 . . . . 0.0 114.422 -178.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.43 -5.03 25.49 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.545 1.538 . . . . 0.0 114.347 171.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 92.1 mt -130.93 125.13 32.67 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.856 2.062 . . . . 0.0 109.438 178.213 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -137.36 74.73 47.31 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 124.612 1.165 . . . . 0.0 110.906 -168.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -71.53 169.15 21.66 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 124.094 3.196 . . . . 0.0 113.355 -178.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -134.76 171.88 13.74 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.667 1.987 . . . . 0.0 111.231 -178.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -124.34 -4.92 7.79 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 126.302 1.841 . . . . 0.0 113.771 176.062 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -65.73 -21.91 66.56 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.238 1.015 . . . . 0.0 113.684 -176.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 -95.0 12.99 26.49 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.425 1.89 . . . . 0.0 113.672 176.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 38.2 t -116.98 134.12 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.422 1.089 . . . . 0.0 111.362 -170.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 89.8 mt -102.2 164.96 11.4 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.593 1.957 . . . . 0.0 111.24 174.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -124.05 138.04 54.5 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 127.196 2.198 . . . . 0.0 107.34 167.657 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -135.42 138.49 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.695 1.198 . . . . 0.0 109.387 -169.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 10.1 m -127.05 136.03 51.63 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.221 1.408 . . . . 0.0 109.501 -177.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -159.91 158.93 27.3 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 124.128 0.971 . . . . 0.0 113.131 -168.901 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -58.02 146.42 87.48 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.464 2.776 . . . . 0.0 111.346 167.241 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.62 -21.29 38.47 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -175.861 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -62.44 -22.47 66.22 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.697 1.599 . . . . 0.0 113.985 174.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.0 m95 -62.96 148.91 46.14 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 122.07 0.938 . . . . 0.0 113.068 173.586 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 25.4 mtmm -132.73 166.19 22.78 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.457 1.903 . . . . 0.0 111.377 -172.873 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.5 m -52.75 -33.68 49.34 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.406 1.083 . . . . 0.0 111.837 169.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 75.5 m -66.61 -45.88 77.69 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.492 1.117 . . . . 0.0 113.912 173.081 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.54 -34.49 77.91 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.508 -0.745 . . . . 0.0 111.079 175.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 77.3 mt -67.42 -43.86 80.18 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.251 1.02 . . . . 0.0 111.278 173.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.48 -42.09 86.72 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.112 -0.993 . . . . 0.0 112.507 170.67 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -64.97 -30.53 71.53 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.168 0.894 . . . . 0.0 113.191 175.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 51.6 tp -74.51 -29.88 61.58 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.554 1.142 . . . . 0.0 113.262 175.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -122.01 -4.34 9.05 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -169.811 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 83.0 p -57.96 -23.27 53.0 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 120.064 1.302 . . . . 0.0 114.256 174.053 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.13 -14.63 7.25 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.64 1.576 . . . . 0.0 114.345 171.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -109.86 3.07 20.29 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.888 1.675 . . . . 0.0 113.309 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 101.87 -158.53 18.43 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.822 1.201 . . . . 0.0 112.801 -176.6 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -63.53 152.89 37.33 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.428 0.691 . . . . 0.0 112.199 170.036 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 31.4 pt -143.93 174.64 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.485 1.514 . . . . 0.0 111.659 -173.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -137.24 151.57 48.88 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.433 1.493 . . . . 0.0 110.177 168.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 71.5 mt -136.17 131.19 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 124.479 1.112 . . . . 0.0 110.303 -169.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 51.7 m -137.54 103.73 5.13 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.131 1.772 . . . . 0.0 109.763 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 61.4 m95 -75.32 160.44 30.32 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.54 -0.725 . . . . 0.0 112.852 -174.085 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 29.9 pt -135.48 -18.94 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.807 1.243 . . . . 0.0 113.677 175.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -151.65 179.05 8.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.651 1.18 . . . . 0.0 111.737 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -69.23 -10.8 59.48 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.563 1.545 . . . . 0.0 113.05 170.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 39.9 p -135.43 3.34 3.06 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.839 1.656 . . . . 0.0 113.929 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 89.1 p -155.15 155.37 33.83 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 170.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -154.15 160.37 41.86 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.195 1.398 . . . . 0.0 112.473 -176.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -91.76 148.88 21.92 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.907 0.883 . . . . 0.0 110.675 168.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 48.8 t -136.42 111.78 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.808 1.243 . . . . 0.0 110.28 178.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 69.8 m -79.07 115.57 18.83 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.666 1.586 . . . . 0.0 110.575 173.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 65.7 mt -82.73 163.61 21.19 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.384 0.673 . . . . 0.0 111.02 169.48 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 87.5 p -67.47 -21.57 65.52 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 176.608 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -147.76 145.03 20.03 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.445 1.498 . . . . 0.0 111.691 -177.528 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -71.54 -18.07 29.59 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.411 2.741 . . . . 0.0 113.372 172.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -62.45 -26.9 68.76 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.043 -1.036 . . . . 0.0 112.789 172.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -92.97 -17.62 23.71 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.546 1.138 . . . . 0.0 113.012 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 28.9 t -57.39 -45.28 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.748 1.219 . . . . 0.0 110.973 171.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -61.73 -34.59 76.09 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.47 0.708 . . . . 0.0 112.753 177.218 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 47.6 mt -68.23 -46.09 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.613 0.765 . . . . 0.0 110.367 178.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.73 -40.67 97.91 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.432 -0.792 . . . . 0.0 112.725 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 73.1 t -67.98 -32.31 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.014 0.926 . . . . 0.0 112.441 175.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -68.96 -47.91 64.47 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.099 -1.001 . . . . 0.0 112.07 171.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 24.3 p -76.23 -22.81 54.77 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -172.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 55.8 p -61.17 -18.23 57.07 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 175.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -55.59 -19.84 11.59 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.015 1.726 . . . . 0.0 113.601 169.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -122.99 18.76 10.09 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.14 1.776 . . . . 0.0 112.671 -175.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -60.62 162.94 5.9 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.522 1.529 . . . . 0.0 113.913 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -129.74 -15.21 3.96 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -171.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 14.9 t -154.95 10.93 0.35 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.034 1.334 . . . . 0.0 112.75 -176.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -158.07 175.39 13.86 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.124 1.37 . . . . 0.0 111.913 -169.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -145.6 152.44 39.68 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.961 1.704 . . . . 0.0 110.402 169.754 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 42.2 mt -136.17 142.71 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.44 1.496 . . . . 0.0 110.317 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -146.9 169.13 19.79 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.852 2.061 . . . . 0.0 109.808 169.624 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 16.8 p -71.8 164.63 25.65 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 120.038 -1.664 . . . . 0.0 112.404 171.758 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -56.28 -42.25 77.18 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.105 -0.997 . . . . 0.0 111.856 169.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.39 87.19 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.687 0.795 . . . . 0.0 112.94 177.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -64.37 -41.37 96.73 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.352 -0.843 . . . . 0.0 111.965 172.643 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -58.61 -49.59 76.93 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.973 0.806 . . . . 0.0 111.677 172.72 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 37.6 t -56.52 -44.29 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.071 0.949 . . . . 0.0 111.934 176.378 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -75.19 -9.29 84.11 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 124.275 0.94 . . . . 0.0 115.383 -178.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -125.71 10.48 7.76 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 126.533 1.933 . . . . 0.0 113.16 -177.444 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -62.1 -19.47 63.02 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.532 1.933 . . . . 0.0 114.837 -173.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 29.5 mp0 -56.74 138.45 52.97 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.686 1.595 . . . . 0.0 112.297 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -65.2 128.42 35.74 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.255 1.022 . . . . 0.0 111.311 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 169.17 50.79 0.03 OUTLIER Glycine 0 CA--C 1.534 1.22 0 C-N-CA 123.906 0.765 . . . . 0.0 113.408 -173.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -138.18 167.2 22.33 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.47 1.508 . . . . 0.0 113.196 -171.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 50.2 tp60 -148.59 151.16 34.56 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.074 1.75 . . . . 0.0 110.374 -179.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.0 m -72.82 1.84 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 115.178 1.548 . . . . 0.0 115.178 -177.685 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -53.67 137.66 36.79 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.892 1.677 . . . . 0.0 112.409 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 8.7 t -152.57 173.58 15.0 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.403 1.481 . . . . 0.0 111.753 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 175.16 -49.02 0.13 Allowed Glycine 0 CA--C 1.54 1.612 0 C-N-CA 125.006 1.288 . . . . 0.0 114.88 -179.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -59.59 -24.36 74.87 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.925 3.083 . . . . 0.0 116.156 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 50.3 m -60.19 148.15 37.32 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.826 1.25 . . . . 0.0 113.342 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 52.3 m -83.09 -0.4 48.92 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -175.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.236 0 C-N-CA 125.94 1.733 . . . . 0.0 113.391 179.715 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . 0.493 ' H81' " O4'" ' A' ' 524' ' ' GDP . . . . . . . . 0 O4'--C4' 1.421 -2.68 0 C5'-C4'-O4' 112.533 2.381 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 524' ' ' GDP . . . . . 0.493 " O4'" ' H81' ' A' ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.551 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 56.4 p -53.51 -25.41 16.56 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 125.262 1.425 . . . . 0.0 114.288 176.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 33.2 p -53.79 -15.29 1.21 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 127.195 2.198 . . . . 0.0 115.355 169.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -149.78 23.86 1.17 Allowed Glycine 0 CA--C 1.537 1.463 0 C-N-CA 125.193 1.377 . . . . 0.0 114.919 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 76.7 p -141.33 -0.05 1.46 Allowed 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -177.736 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 95.7 p -146.24 170.2 17.23 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.241 1.016 . . . . 0.0 113.401 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -175.64 -169.92 37.88 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 125.625 1.583 . . . . 0.0 112.838 -175.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -169.36 -175.64 38.72 Favored Glycine 0 CA--C 1.543 1.783 0 C-N-CA 124.012 0.815 . . . . 0.0 114.705 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -52.99 163.94 1.87 Allowed 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 125.227 3.951 . . . . 0.0 115.549 177.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -145.41 163.98 32.93 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.268 1.427 . . . . 0.0 111.979 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.75 178.08 2.75 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.265 1.826 . . . . 0.0 113.472 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 52.87 58.44 14.4 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 126.747 2.019 . . . . 0.0 115.136 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -66.31 166.29 21.86 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.205 2.604 . . . . 0.0 112.325 171.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 37.8 tttm -130.72 27.25 4.97 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.149 1.379 . . . . 0.0 113.507 -170.272 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -126.88 2.88 6.63 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.107 1.763 . . . . 0.0 114.168 -178.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.33 -12.72 44.86 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.082 1.353 . . . . 0.0 114.298 -178.394 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -115.28 13.46 16.67 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.187 2.195 . . . . 0.0 113.062 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 54.7 t -114.24 125.02 71.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.606 1.162 . . . . 0.0 111.153 -170.549 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.6 mt -92.23 164.11 13.67 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.374 1.47 . . . . 0.0 111.79 170.372 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -122.41 134.76 54.6 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 127.19 2.196 . . . . 0.0 106.663 166.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.8 t -130.18 136.36 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 125.111 1.364 . . . . 0.0 109.022 -169.344 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 11.6 m -129.66 135.57 48.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.081 1.353 . . . . 0.0 109.422 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -158.9 158.38 29.04 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 123.904 0.881 . . . . 0.0 112.788 -169.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -56.46 143.23 88.09 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 122.976 2.451 . . . . 0.0 110.82 166.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -58.13 -19.45 32.64 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -176.171 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -61.52 -21.37 64.17 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.171 1.388 . . . . 0.0 113.946 174.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -64.02 151.1 43.83 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.801 0.84 . . . . 0.0 112.541 172.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -136.64 167.66 20.99 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.044 1.738 . . . . 0.0 111.568 179.055 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.9 m -51.62 -36.38 45.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.242 1.417 . . . . 0.0 112.817 177.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 72.5 m -67.63 -39.12 84.67 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 176.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -67.38 -31.7 72.11 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.319 -0.863 . . . . 0.0 110.965 173.63 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.3 mt -71.18 -46.24 61.77 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.068 0.947 . . . . 0.0 111.223 176.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -57.16 -37.87 72.72 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.029 -1.044 . . . . 0.0 112.846 171.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -69.72 -37.41 76.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.092 0.957 . . . . 0.0 113.31 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 66.2 tp -62.83 -34.25 76.93 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.559 1.143 . . . . 0.0 112.233 176.691 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -105.23 5.95 32.53 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 -176.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 21.4 t -54.93 -29.27 55.93 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.908 1.283 . . . . 0.0 113.406 176.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.82 -13.02 5.09 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.81 1.644 . . . . 0.0 115.21 173.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -117.61 5.74 12.41 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.702 1.601 . . . . 0.0 113.168 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 78.19 -148.47 32.9 Favored Glycine 0 CA--C 1.535 1.314 0 O-C-N 121.291 -0.88 . . . . 0.0 112.992 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -59.67 142.5 52.88 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.218 1.007 . . . . 0.0 112.678 177.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 10.2 pt -143.59 177.86 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 126.29 1.836 . . . . 0.0 111.287 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -132.57 144.85 50.67 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.634 1.174 . . . . 0.0 110.048 169.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.1 mt -126.41 131.85 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.157 1.383 . . . . 0.0 109.044 -172.031 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 56.8 m -134.92 96.43 3.52 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.799 1.64 . . . . 0.0 110.755 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -57.46 150.03 19.59 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.256 1.022 . . . . 0.0 113.209 177.326 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 38.1 pt -133.16 -19.13 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.658 1.183 . . . . 0.0 113.237 170.117 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -152.06 170.87 18.87 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.247 1.419 . . . . 0.0 111.785 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -61.46 -17.52 54.83 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.16 1.784 . . . . 0.0 113.097 170.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 72.8 p -130.04 4.1 4.86 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.979 1.712 . . . . 0.0 114.69 -176.631 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 98.7 p -154.74 157.09 37.5 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 174.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.69 163.18 40.16 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.771 1.629 . . . . 0.0 112.207 -177.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -98.26 151.36 20.56 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.425 1.09 . . . . 0.0 110.18 167.818 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 89.6 t -139.32 117.85 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.05 0.94 . . . . 0.0 111.088 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 73.2 m -83.16 116.29 22.29 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.55 1.54 . . . . 0.0 110.581 173.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 64.0 mt -85.65 160.4 19.59 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.169 0.987 . . . . 0.0 111.649 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 93.7 p -73.01 -19.83 61.12 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -142.27 149.14 50.59 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.48 1.512 . . . . 0.0 110.925 174.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -70.25 -23.71 28.26 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.943 2.428 . . . . 0.0 113.645 179.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -63.68 -30.05 71.2 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.944 -1.097 . . . . 0.0 112.679 175.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -69.56 -24.44 63.7 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.09 1.356 . . . . 0.0 112.685 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.69 -47.46 91.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.398 1.079 . . . . 0.0 110.987 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -62.13 -37.94 87.06 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.103 0.561 . . . . 0.0 112.068 177.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 68.0 mt -62.04 -54.72 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.732 0.813 . . . . 0.0 110.143 176.499 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.15 86.13 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -178.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 65.0 t -63.8 -45.09 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.239 -0.913 . . . . 0.0 110.922 172.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.73 -45.93 91.81 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.72 0.808 . . . . 0.0 112.93 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.9 p -70.17 -22.78 62.93 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.269 1.028 . . . . 0.0 113.513 -177.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 47.5 m -90.0 -6.56 55.47 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -177.258 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt -56.41 -16.4 5.7 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 172.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -126.49 9.93 7.22 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.967 1.707 . . . . 0.0 113.035 -173.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.4 156.16 33.14 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.801 1.241 . . . . 0.0 112.795 177.358 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -131.28 -6.74 3.81 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 43.0 m -132.3 1.78 3.83 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.204 1.402 . . . . 0.0 113.511 -177.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 45.8 p90 -163.02 174.39 12.35 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.812 2.445 . . . . 0.0 109.621 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -147.6 148.21 30.88 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.567 1.547 . . . . 0.0 110.868 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 74.7 mt -131.7 144.98 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 125.684 1.593 . . . . 0.0 110.505 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -147.17 170.56 16.97 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.933 2.093 . . . . 0.0 109.87 171.329 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 20.9 p -73.5 162.92 28.72 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.576 -1.328 . . . . 0.0 111.716 172.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -55.1 -41.15 71.24 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.409 -0.807 . . . . 0.0 112.156 169.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -70.02 -38.02 75.78 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 179.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -64.38 -41.27 96.78 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.413 -0.805 . . . . 0.0 111.698 173.661 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -56.11 -50.91 69.73 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.423 0.689 . . . . 0.0 111.791 172.089 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 43.4 t -60.37 -44.31 95.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 124.161 0.984 . . . . 0.0 112.355 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -71.43 -43.09 54.77 Favored Glycine 0 CA--C 1.534 1.262 0 O-C-N 121.725 -0.61 . . . . 0.0 113.454 -174.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -70.59 -22.89 62.51 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.61 1.164 . . . . 0.0 113.475 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -70.32 -10.99 60.57 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.447 1.899 . . . . 0.0 114.379 176.139 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -133.47 170.16 15.91 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.848 1.259 . . . . 0.0 113.885 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -120.81 -34.78 3.49 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.421 1.488 . . . . 0.0 114.572 -172.531 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 135.8 -25.93 3.19 Favored Glycine 0 N--CA 1.478 1.452 0 N-CA-C 116.476 1.35 . . . . 0.0 116.476 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -122.11 3.82 9.85 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 125.006 1.322 . . . . 0.0 113.918 -173.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -56.97 -22.02 34.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.89 1.676 . . . . 0.0 114.124 178.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 27.1 m -66.98 -18.52 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.965 1.706 . . . . 0.0 114.448 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -143.33 1.79 1.24 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -174.481 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 67.1 p -62.98 -20.31 65.15 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -179.678 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 177.08 179.35 47.4 Favored Glycine 0 CA--C 1.541 1.691 0 C-N-CA 124.846 1.212 . . . . 0.0 113.877 174.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.32 -21.85 46.42 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.59 3.527 . . . . 0.0 115.627 176.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 13.2 t -149.49 171.99 15.71 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.095 1.758 . . . . 0.0 111.222 179.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 20.9 m -128.32 5.17 5.74 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.747 1.619 . . . . 0.0 113.724 -172.348 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.303 0 C-N-CA 125.493 1.52 . . . . 0.0 113.781 177.226 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 0 C5'-C4'-O4' 113.919 3.371 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.522 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 10.5 t -151.96 164.56 36.9 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.196 1.398 . . . . 0.0 111.472 178.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 28.0 m -137.38 -1.8 2.07 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.122 1.369 . . . . 0.0 114.309 -174.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 164.1 177.1 36.57 Favored Glycine 0 CA--C 1.535 1.344 0 C-N-CA 124.275 0.94 . . . . 0.0 114.088 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 80.4 p -141.28 -0.17 1.45 Allowed 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -177.291 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 60.0 p -70.47 165.28 22.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.117 1.367 . . . . 0.0 113.282 175.045 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 166.18 -29.2 0.19 Allowed Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.153 0.883 . . . . 0.0 114.635 175.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 178.77 175.52 45.89 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 124.822 1.201 . . . . 0.0 113.405 176.302 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -72.34 -18.73 26.21 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.794 2.996 . . . . 0.0 113.67 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -149.37 133.61 17.34 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.863 1.665 . . . . 0.0 110.39 175.531 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 96.1 mt -145.37 172.1 13.67 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.729 2.011 . . . . 0.0 110.397 -176.27 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -142.57 151.44 57.41 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 124.227 1.011 . . . . 0.0 112.878 176.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -59.14 163.78 11.43 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.861 3.041 . . . . 0.0 114.402 169.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.46 24.51 3.46 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 126.54 1.936 . . . . 0.0 111.949 170.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -133.34 29.33 3.98 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 127.179 2.191 . . . . 0.0 112.699 -169.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -59.74 -22.23 61.79 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.69 1.196 . . . . 0.0 113.782 176.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 -82.53 7.54 14.2 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.545 1.938 . . . . 0.0 114.285 173.786 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 19.6 t -123.39 140.79 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 125.064 1.345 . . . . 0.0 111.509 -170.704 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 82.2 mt -115.43 164.69 13.92 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 127.573 2.349 . . . . 0.0 110.499 176.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -122.88 140.86 52.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.556 1.942 . . . . 0.0 108.246 168.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.5 t -133.47 138.16 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 124.772 1.229 . . . . 0.0 109.202 -170.445 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 12.1 m -128.19 137.91 52.25 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.142 1.377 . . . . 0.0 109.511 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -158.8 158.66 29.38 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.184 0.994 . . . . 0.0 112.38 -169.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -54.98 142.51 76.11 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.258 2.639 . . . . 0.0 111.89 168.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -57.0 -21.22 28.99 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.61 -20.66 66.4 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.013 1.325 . . . . 0.0 114.006 174.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -64.81 151.79 44.47 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.817 0.847 . . . . 0.0 112.194 173.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -133.26 171.9 13.41 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.902 1.681 . . . . 0.0 112.054 177.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.7 m -50.7 -35.03 29.13 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.475 1.51 . . . . 0.0 112.399 174.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.6 m -63.9 -44.76 92.04 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 174.72 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -65.48 -31.14 72.05 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.353 0.661 . . . . 0.0 111.391 175.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 83.6 mt -72.2 -45.87 58.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.804 0.842 . . . . 0.0 111.587 176.313 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.1 -36.17 74.69 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.101 -0.999 . . . . 0.0 112.616 170.189 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -68.28 -39.37 82.17 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.886 0.766 . . . . 0.0 112.842 174.2 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 48.4 tp -65.99 -40.82 91.51 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.713 1.205 . . . . 0.0 112.028 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -99.62 9.71 42.66 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.022 0.929 . . . . 0.0 113.471 -177.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 21.7 t -54.84 -31.48 59.52 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.459 1.504 . . . . 0.0 113.599 177.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.48 -14.0 6.87 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.585 1.554 . . . . 0.0 115.081 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -106.42 0.77 25.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.261 1.425 . . . . 0.0 113.767 -177.474 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.86 -47.19 3.26 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 126.097 1.808 . . . . 0.0 115.81 169.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -144.07 137.64 27.72 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.421 1.489 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 22.1 pt -146.5 174.92 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.386 1.474 . . . . 0.0 111.851 -172.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -143.8 148.04 35.0 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.942 1.297 . . . . 0.0 109.071 167.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 49.8 mt -130.9 136.28 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.257 1.023 . . . . 0.0 110.095 -173.205 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 37.5 m -135.13 102.75 5.3 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.745 1.618 . . . . 0.0 110.652 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -59.32 150.47 25.97 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.024 0.93 . . . . 0.0 113.486 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 36.8 pt -135.28 -21.07 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.632 1.173 . . . . 0.0 113.874 170.789 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -152.27 178.97 8.94 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.684 1.194 . . . . 0.0 112.013 175.541 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -68.27 -14.09 62.73 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.752 1.221 . . . . 0.0 113.234 173.175 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.2 p -132.94 3.52 3.75 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.637 1.575 . . . . 0.0 113.769 -172.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 97.1 p -154.26 155.91 36.07 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 174.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.47 159.51 42.32 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.025 1.73 . . . . 0.0 111.61 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -89.8 150.16 22.38 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.68 0.792 . . . . 0.0 110.28 167.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 60.4 t -137.82 121.36 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.921 1.288 . . . . 0.0 110.235 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 74.7 m -89.12 142.37 27.7 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.871 1.268 . . . . 0.0 110.929 173.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 82.3 mt -125.54 155.69 40.22 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.441 1.496 . . . . 0.0 110.511 175.202 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 67.0 m -68.84 -24.26 64.35 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -171.394 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -144.85 154.7 55.61 Favored Pre-proline 0 N--CA 1.474 0.732 0 C-N-CA 124.875 1.27 . . . . 0.0 112.503 -177.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.07 -21.47 27.43 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.109 2.539 . . . . 0.0 113.007 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.33 -40.66 97.06 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.223 -0.923 . . . . 0.0 111.376 169.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -66.42 -39.9 89.23 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.308 -0.87 . . . . 0.0 111.54 177.153 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 93.3 t -59.06 -47.76 88.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.449 1.1 . . . . 0.0 110.837 171.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -62.3 -39.5 93.22 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.516 0.726 . . . . 0.0 112.812 177.344 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.84 -46.16 97.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.757 0.823 . . . . 0.0 111.02 174.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.3 -38.58 89.93 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.117 0.872 . . . . 0.0 112.882 177.015 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.1 t -66.58 -37.25 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.187 0.995 . . . . 0.0 112.088 172.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -71.22 -31.0 67.04 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.23 -0.919 . . . . 0.0 113.281 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 23.9 p -91.58 -18.8 23.5 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -174.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 67.5 p -67.37 -21.61 65.61 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -61.78 -13.06 20.21 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -134.54 27.91 3.67 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.184 1.794 . . . . 0.0 112.729 174.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -54.95 150.24 10.48 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.26 1.424 . . . . 0.0 113.798 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -72.17 -37.6 69.3 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.566 1.146 . . . . 0.0 113.8 -174.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 32.8 t -164.46 -39.86 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.078 1.351 . . . . 0.0 112.149 -178.624 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -62.69 172.77 1.5 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.846 1.658 . . . . 0.0 112.72 169.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -142.9 149.24 38.21 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.212 1.805 . . . . 0.0 110.218 171.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 72.3 mt -133.52 140.8 45.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 125.726 1.61 . . . . 0.0 109.254 -179.011 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -145.31 166.16 26.34 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.388 1.875 . . . . 0.0 110.186 173.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 30.2 p -71.16 163.52 27.46 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.454 -1.404 . . . . 0.0 112.226 173.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -54.43 -41.14 69.04 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.534 -0.729 . . . . 0.0 112.117 169.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.23 -39.18 89.36 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.873 0.869 . . . . 0.0 113.264 177.229 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -65.13 -34.09 77.57 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.277 -0.889 . . . . 0.0 112.831 174.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -69.76 -47.48 62.83 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.393 0.677 . . . . 0.0 112.238 171.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 6.4 t -53.9 -40.19 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.732 1.213 . . . . 0.0 112.632 173.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -64.77 -19.86 65.69 Favored Glycine 0 CA--C 1.54 1.628 0 O-C-N 121.569 -0.707 . . . . 0.0 114.378 177.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -89.92 -19.55 24.42 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.205 1.402 . . . . 0.0 113.326 173.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -72.52 2.21 6.75 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.942 1.697 . . . . 0.0 114.295 169.796 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -52.17 -18.78 1.63 Allowed 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -55.88 -25.61 43.41 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.505 1.122 . . . . 0.0 113.67 170.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -77.85 -8.28 87.3 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 124.923 1.249 . . . . 0.0 115.293 176.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -63.41 -18.66 63.95 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.559 1.544 . . . . 0.0 114.553 -178.335 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -72.63 37.02 0.07 Allowed 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 126.491 1.916 . . . . 0.0 114.258 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 43.4 t -55.54 -24.54 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 126.457 1.903 . . . . 0.0 112.806 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 22.8 ptmt -57.68 -11.62 2.29 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 127.0 2.12 . . . . 0.0 116.166 172.486 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 14.7 t -142.49 156.25 45.14 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.164 1.386 . . . . 0.0 112.324 -176.62 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 164.66 -178.44 39.84 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 125.045 1.307 . . . . 0.0 113.551 -177.365 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -52.65 -17.23 6.66 Favored 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 125.288 3.992 . . . . 0.0 117.176 -178.18 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 78.3 p -126.33 7.21 7.06 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.068 1.747 . . . . 0.0 113.878 -178.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 79.3 p -143.51 -0.76 1.06 Allowed 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -175.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.643 1.592 . . . . 0.0 112.947 175.134 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 523' ' ' 7MG . . . . . 0.499 ' H81' " O4'" ' A' ' 524' ' ' GDP . . . . . . . . 0 O4'--C4' 1.422 -2.608 0 C5'-C4'-O4' 111.528 1.663 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 524' ' ' GDP . . . . . 0.499 " O4'" ' H81' ' A' ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? . . . . . 0 N--CA 1.483 1.2 0 N-CA-C 112.755 0.65 . . . . 0.0 112.755 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.44 -19.04 63.09 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.575 1.15 . . . . 0.0 113.906 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -96.98 12.35 32.77 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.143 2.177 . . . . 0.0 113.528 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 45.2 t -120.55 142.56 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.248 1.419 . . . . 0.0 110.995 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 96.3 mt -113.35 163.48 14.8 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 127.201 2.201 . . . . 0.0 111.352 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -123.0 138.71 54.62 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 127.043 2.137 . . . . 0.0 107.433 167.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 8.1 t -133.03 137.74 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.794 1.237 . . . . 0.0 109.017 -169.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 15.8 m -127.35 135.52 50.63 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.816 1.246 . . . . 0.0 109.754 -178.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -158.08 158.61 30.12 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.772 1.229 . . . . 0.0 112.303 -169.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.42 148.12 34.87 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.844 3.029 . . . . 0.0 113.17 168.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -58.87 -16.16 16.07 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.737 1.755 . . . . 0.0 115.737 -176.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -82.36 -14.71 54.84 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.31 1.444 . . . . 0.0 113.948 177.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -62.62 148.72 45.41 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.129 0.877 . . . . 0.0 112.134 173.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -129.69 165.91 20.9 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.962 1.705 . . . . 0.0 111.781 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 m -50.51 -36.06 32.29 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.765 1.226 . . . . 0.0 112.42 172.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.1 m -65.89 -41.54 91.39 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 175.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -64.82 -31.61 72.92 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.737 -0.602 . . . . 0.0 111.18 173.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.62 -46.29 54.83 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.103 0.961 . . . . 0.0 111.573 177.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -58.55 -38.33 77.59 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.23 -0.919 . . . . 0.0 112.48 169.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -67.2 -39.74 86.38 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.908 0.776 . . . . 0.0 112.879 175.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 41.7 tp -65.54 -44.16 87.72 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.792 1.237 . . . . 0.0 111.687 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -95.36 6.9 47.79 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -175.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 8.7 t -55.18 -26.67 40.52 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.181 1.393 . . . . 0.0 113.413 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -61.06 -10.56 6.29 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.689 1.595 . . . . 0.0 114.973 174.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -122.68 8.03 9.46 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.501 1.52 . . . . 0.0 113.543 -174.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 80.8 -145.8 26.38 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 121.239 -0.913 . . . . 0.0 113.213 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -63.31 144.03 57.3 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.076 0.95 . . . . 0.0 112.401 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.9 pt -144.95 175.72 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 126.335 1.854 . . . . 0.0 111.491 -175.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -136.16 150.35 49.01 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.47 1.508 . . . . 0.0 109.392 168.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 69.0 mt -133.58 133.49 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.208 1.403 . . . . 0.0 109.227 -171.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 42.7 m -136.13 100.51 4.43 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.658 1.583 . . . . 0.0 111.196 -177.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -59.8 151.06 26.42 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 32.1 pt -135.09 -20.12 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 124.837 1.255 . . . . 0.0 113.622 169.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -152.37 -179.12 7.27 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.66 1.184 . . . . 0.0 112.104 175.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.33 -25.66 68.14 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.888 1.275 . . . . 0.0 112.719 170.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.7 p -125.29 4.13 7.78 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.949 1.699 . . . . 0.0 114.026 -169.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 93.4 p -154.58 156.16 36.05 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 172.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.84 160.18 42.1 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.954 1.702 . . . . 0.0 111.459 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -90.86 150.99 21.32 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.525 0.73 . . . . 0.0 110.108 167.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 68.6 t -138.66 126.6 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 124.855 1.262 . . . . 0.0 109.896 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 9.4 t -95.28 137.38 34.41 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.504 1.122 . . . . 0.0 111.253 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 71.9 mt -122.54 158.75 29.2 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.066 1.747 . . . . 0.0 110.177 177.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 99.0 p -80.67 -9.85 59.77 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -171.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -145.74 151.09 45.27 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.109 1.364 . . . . 0.0 111.915 177.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -71.57 -19.52 28.09 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.209 2.606 . . . . 0.0 113.308 172.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -65.13 -40.3 94.25 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.683 -1.261 . . . . 0.0 111.677 170.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -64.93 -39.04 92.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.734 0.814 . . . . 0.0 111.401 175.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 23.1 t -56.84 -50.71 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.368 1.067 . . . . 0.0 111.173 170.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -60.48 -41.69 94.73 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.391 0.541 . . . . 0.0 112.311 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 81.1 mt -62.62 -47.11 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.862 0.865 . . . . 0.0 111.28 175.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.55 -40.71 97.68 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 119.232 0.923 . . . . 0.0 112.874 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 77.9 t -66.97 -34.01 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.184 0.994 . . . . 0.0 112.172 175.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -70.28 -46.43 64.37 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.114 -0.991 . . . . 0.0 112.221 173.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 24.0 p -73.81 -25.22 59.99 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -174.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 53.7 p -66.4 -19.71 65.87 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -57.39 -22.38 42.46 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.813 1.245 . . . . 0.0 113.746 174.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -98.5 -5.62 31.88 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.198 1.399 . . . . 0.0 113.42 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -77.17 145.5 37.64 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.482 1.113 . . . . 0.0 112.562 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -129.76 0.46 4.87 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.908 1.283 . . . . 0.0 114.286 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 46.6 m -126.61 0.86 6.84 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.809 1.644 . . . . 0.0 112.986 177.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -161.22 171.63 18.1 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.524 2.33 . . . . 0.0 109.741 175.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 18.3 tpp85 -148.64 155.13 40.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.855 1.262 . . . . 0.0 111.127 169.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 73.9 mt -134.66 141.59 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.052 1.741 . . . . 0.0 109.387 -173.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -145.96 168.68 20.28 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.259 1.824 . . . . 0.0 110.557 172.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 30.4 p -71.62 163.03 28.52 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 120.662 -1.274 . . . . 0.0 112.347 173.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -57.21 -40.8 78.18 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.263 -0.898 . . . . 0.0 111.733 169.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.73 85.12 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.763 0.825 . . . . 0.0 113.03 177.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.38 -42.31 96.21 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.235 -0.916 . . . . 0.0 112.212 171.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 90.4 t80 . . . . . 0 CA--C 1.542 0.635 0 CA-C-N 119.03 0.832 . . . . 0.0 111.989 174.873 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.9 mmt-85 . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 112.927 0.714 . . . . 0.0 112.927 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -58.74 -19.54 41.23 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.161 1.384 . . . . 0.0 113.731 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -115.34 16.61 16.76 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.588 2.355 . . . . 0.0 112.904 -175.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 42.9 t -123.1 138.47 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.677 1.191 . . . . 0.0 112.165 -170.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 76.8 mt -118.22 164.3 15.38 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 127.191 2.196 . . . . 0.0 110.839 175.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -118.09 141.96 47.92 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.802 2.041 . . . . 0.0 107.908 167.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.7 t -133.16 139.25 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.556 1.542 . . . . 0.0 109.107 -171.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.5 m -128.14 134.87 49.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.346 1.458 . . . . 0.0 109.594 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -158.32 158.58 29.85 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.715 1.206 . . . . 0.0 111.539 -170.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -66.17 151.16 84.31 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.061 1.841 . . . . 0.0 111.065 169.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -60.65 -11.72 8.14 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -66.68 -19.81 65.84 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.47 1.108 . . . . 0.0 113.522 171.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -73.61 153.31 40.24 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.285 1.034 . . . . 0.0 112.758 175.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 173.46 11.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.6 1.96 . . . . 0.0 111.691 175.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 m -49.12 -35.77 17.25 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.197 1.399 . . . . 0.0 112.395 171.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.7 m -64.5 -43.31 94.51 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 176.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -65.92 -31.61 72.64 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.653 -0.654 . . . . 0.0 111.187 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.0 mt -71.44 -43.7 66.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.868 0.867 . . . . 0.0 111.502 175.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -58.68 -42.43 88.51 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.943 -1.098 . . . . 0.0 111.753 169.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -62.81 -33.82 76.02 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 119.035 0.834 . . . . 0.0 112.971 176.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.2 tp -73.37 -29.93 62.95 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.789 1.236 . . . . 0.0 113.369 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -121.06 -0.2 10.06 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -169.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 78.0 p -56.88 -23.91 48.03 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 176.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -57.71 -17.07 13.03 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.469 1.508 . . . . 0.0 114.545 174.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -99.56 3.71 45.54 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.218 1.407 . . . . 0.0 113.99 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.67 -44.1 3.04 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.955 1.741 . . . . 0.0 115.817 168.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -150.16 133.84 16.7 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.878 1.271 . . . . 0.0 110.594 177.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.9 pt -146.1 173.25 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.018 1.327 . . . . 0.0 112.101 -172.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 62.8 tp60 -139.92 139.1 36.1 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.002 1.321 . . . . 0.0 108.817 167.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 71.8 mt -112.94 132.36 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.11 1.364 . . . . 0.0 108.279 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 57.9 m -141.03 95.97 2.93 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.258 1.423 . . . . 0.0 111.095 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -57.97 152.68 15.81 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -177.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 37.7 pt -134.26 -19.8 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 125.21 1.404 . . . . 0.0 113.398 169.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -153.64 178.27 10.04 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.733 1.213 . . . . 0.0 111.994 174.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -63.61 -17.42 62.86 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.36 1.864 . . . . 0.0 112.733 171.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.2 p -135.07 7.59 3.42 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 127.197 2.199 . . . . 0.0 113.64 -171.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 4.0 m -149.66 146.37 27.23 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.21 1.004 . . . . 0.0 113.693 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.44 158.98 43.4 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.189 1.395 . . . . 0.0 112.04 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -90.38 152.75 20.86 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.75 0.82 . . . . 0.0 109.726 167.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.0 t -136.11 115.05 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 C-N-CA 124.231 1.012 . . . . 0.0 110.42 173.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 24.0 m -79.21 143.36 35.42 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.248 1.419 . . . . 0.0 109.831 169.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 76.7 mt -119.7 161.6 20.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.938 1.295 . . . . 0.0 111.092 175.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 21.1 t -60.32 -34.84 74.39 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.627 1.171 . . . . 0.0 113.673 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -140.32 151.53 64.55 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 125.179 1.392 . . . . 0.0 111.684 -177.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -69.21 -23.71 32.99 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.129 2.553 . . . . 0.0 113.868 -178.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.72 -33.64 75.53 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 120.863 -1.148 . . . . 0.0 112.387 173.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -66.1 -27.71 68.26 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.284 1.033 . . . . 0.0 112.785 -179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 90.0 t -61.93 -46.56 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.776 1.23 . . . . 0.0 110.617 173.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -63.53 -41.25 98.48 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.642 0.777 . . . . 0.0 111.699 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.32 -51.32 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.652 0.781 . . . . 0.0 110.528 175.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.89 90.88 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.8 t -62.77 -36.72 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 O-C-N 121.025 -1.047 . . . . 0.0 111.754 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -73.11 -30.57 63.74 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -91.48 -33.06 15.35 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -176.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 90.0 p -70.08 -17.75 63.24 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 50.7 pttt -59.93 -12.07 7.0 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.162 1.541 . . . . 0.0 115.162 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -101.01 1.31 39.44 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.898 1.679 . . . . 0.0 113.968 178.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -61.85 159.26 14.2 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.63 1.172 . . . . 0.0 113.958 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.82 -1.93 2.18 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.033 1.333 . . . . 0.0 114.57 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 78.2 p -140.81 1.48 1.69 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.446 1.498 . . . . 0.0 114.172 -176.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -156.75 175.43 14.07 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.038 2.135 . . . . 0.0 109.983 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 76.6 ttt-85 -145.85 150.89 36.98 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.351 1.46 . . . . 0.0 110.895 172.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 85.0 mt -131.88 144.93 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 126.18 1.792 . . . . 0.0 109.577 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -150.27 169.27 21.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.735 1.614 . . . . 0.0 110.747 169.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 59.9 p -71.06 162.63 29.1 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 120.815 -1.178 . . . . 0.0 112.229 174.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -58.13 -37.57 74.86 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 121.386 -0.821 . . . . 0.0 112.085 169.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.71 -38.39 89.05 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.76 0.824 . . . . 0.0 113.0 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -67.66 -39.18 84.56 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.117 -0.989 . . . . 0.0 112.545 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 26.2 t80 . . . . . 0 CA--C 1.544 0.733 0 C-N-CA 123.775 0.83 . . . . 0.0 111.737 172.654 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -63.53 -23.85 67.56 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.569 1.147 . . . . 0.0 113.442 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -93.71 17.57 11.65 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 127.502 2.321 . . . . 0.0 113.584 176.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 24.6 t -126.52 135.88 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.813 1.245 . . . . 0.0 111.399 -170.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 89.7 mt -103.11 167.0 10.11 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.693 1.997 . . . . 0.0 111.8 174.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -122.95 135.69 54.58 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 127.376 2.27 . . . . 0.0 107.224 167.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.4 t -131.35 140.16 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.797 1.239 . . . . 0.0 109.084 -171.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 9.9 m -131.18 136.62 48.45 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.041 1.336 . . . . 0.0 109.76 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -158.91 158.74 29.34 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.477 1.111 . . . . 0.0 112.415 -169.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -53.79 148.72 35.89 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.79 2.993 . . . . 0.0 113.281 169.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -61.11 -9.33 4.44 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -85.02 -12.23 53.62 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.333 1.453 . . . . 0.0 113.931 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 7.9 m95 -63.61 157.7 23.17 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -131.52 162.93 29.11 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.577 1.951 . . . . 0.0 111.651 -178.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.6 m -52.74 -35.95 56.96 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.763 1.225 . . . . 0.0 111.999 169.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.2 m -66.37 -41.52 89.34 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.496 0.925 . . . . 0.0 113.496 176.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -65.28 -30.68 71.57 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.792 -0.567 . . . . 0.0 111.393 173.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 62.0 mt -70.71 -47.31 60.45 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.867 0.867 . . . . 0.0 111.479 175.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -58.41 -38.93 78.4 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.99 -1.069 . . . . 0.0 112.452 170.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -65.91 -39.34 90.5 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.072 0.851 . . . . 0.0 112.844 175.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.38 -33.84 75.53 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.243 1.417 . . . . 0.0 112.11 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -110.85 9.8 22.47 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.711 1.374 . . . . 0.0 114.711 -174.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 32.8 m -57.97 -22.06 47.38 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 121.03 -1.044 . . . . 0.0 113.771 173.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.08 -15.23 12.8 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.435 1.494 . . . . 0.0 114.685 171.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -113.33 4.01 16.19 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.587 1.555 . . . . 0.0 113.627 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.68 -44.95 2.82 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 126.0 1.762 . . . . 0.0 115.242 172.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -153.3 144.38 22.97 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.826 1.25 . . . . 0.0 111.894 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 15.4 pt -145.35 176.03 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 126.349 1.86 . . . . 0.0 111.611 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -136.85 145.23 44.17 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.944 1.298 . . . . 0.0 109.415 168.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 76.2 mt -123.51 134.51 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.438 1.095 . . . . 0.0 110.051 -169.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.4 m -134.33 96.89 3.69 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 126.216 1.806 . . . . 0.0 109.966 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -55.83 155.8 5.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.475 1.11 . . . . 0.0 113.88 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 12.7 mt -128.49 -39.07 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.967 1.307 . . . . 0.0 109.959 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -153.67 -172.4 4.22 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.71 1.604 . . . . 0.0 110.52 174.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -63.93 -17.75 63.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.687 1.195 . . . . 0.0 113.073 172.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.9 p -127.41 2.87 6.28 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 126.433 1.893 . . . . 0.0 114.332 -169.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 80.1 p -153.73 153.92 33.11 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.94 151.73 31.6 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.45 1.5 . . . . 0.0 111.86 -179.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -89.59 145.87 24.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.936 0.894 . . . . 0.0 108.86 167.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.4 t -137.88 111.26 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.86 0.864 . . . . 0.0 110.984 -176.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 66.5 m -75.87 138.31 41.0 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.917 1.687 . . . . 0.0 110.955 171.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 49.5 mt -112.61 163.39 14.58 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.303 1.041 . . . . 0.0 112.199 178.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 17.6 t -64.37 -34.04 77.25 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.252 1.021 . . . . 0.0 113.318 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -141.11 149.49 55.69 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.333 1.453 . . . . 0.0 111.21 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.44 -24.65 26.32 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.95 2.433 . . . . 0.0 113.991 -177.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.52 -27.03 68.17 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.754 -1.216 . . . . 0.0 113.39 174.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -67.43 -26.14 66.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.434 1.094 . . . . 0.0 112.272 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.5 t -61.78 -45.38 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.936 1.294 . . . . 0.0 110.257 176.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.25 -39.63 92.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.79 0.836 . . . . 0.0 111.825 177.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 99.3 mt -60.96 -49.67 83.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 123.91 0.884 . . . . 0.0 110.573 175.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.15 93.42 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 74.8 t -63.66 -40.62 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.427 -0.795 . . . . 0.0 110.961 173.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -64.05 -45.13 90.17 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.889 0.768 . . . . 0.0 112.836 175.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -72.9 -27.5 61.92 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -176.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 31.7 p -62.77 -19.76 64.31 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -60.07 -12.6 8.64 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.245 1.418 . . . . 0.0 114.011 171.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -121.0 12.09 11.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.009 1.723 . . . . 0.0 112.699 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.72 164.37 10.0 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.661 1.185 . . . . 0.0 113.061 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -132.98 -13.37 2.81 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.141 1.376 . . . . 0.0 113.085 178.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 71.1 p -145.84 7.71 1.09 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.114 1.365 . . . . 0.0 114.682 -170.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -157.72 175.06 14.39 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.978 1.711 . . . . 0.0 111.418 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 -146.4 149.66 34.18 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.219 1.808 . . . . 0.0 110.507 172.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 88.0 mt -133.87 145.67 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.853 1.661 . . . . 0.0 109.605 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.2 pt20 -149.73 170.43 18.74 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.128 1.771 . . . . 0.0 110.36 169.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 25.4 p -72.08 164.51 26.03 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.536 -1.352 . . . . 0.0 112.191 173.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -55.34 -41.79 72.96 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.273 -0.892 . . . . 0.0 111.934 169.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -69.38 -38.13 77.89 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.859 0.864 . . . . 0.0 113.213 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -61.44 -41.31 97.0 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.841 0.856 . . . . 0.0 111.962 173.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 66.1 t80 . . . . . 0 CA--C 1.54 0.561 0 CA-C-N 118.383 0.538 . . . . 0.0 111.843 172.581 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 . . . . . 0 N--CA 1.48 1.043 0 N-CA-C 113.377 0.88 . . . . 0.0 113.377 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -60.34 -14.21 17.24 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.395 1.478 . . . . 0.0 114.524 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 46.3 p-80 -117.3 18.05 14.54 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 128.154 2.582 . . . . 0.0 112.44 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 26.6 t -123.92 143.75 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.239 1.416 . . . . 0.0 111.267 -174.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 70.8 mt -121.88 166.54 14.25 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.462 2.305 . . . . 0.0 110.672 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -125.21 142.82 51.27 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 126.641 1.977 . . . . 0.0 108.395 168.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -135.64 142.46 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.836 1.254 . . . . 0.0 109.558 -169.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 2.0 m -129.65 137.4 50.64 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.119 1.368 . . . . 0.0 109.796 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -159.36 157.3 27.01 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 124.413 1.085 . . . . 0.0 112.371 -169.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.52 143.85 65.65 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.721 2.947 . . . . 0.0 112.75 169.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -55.61 -25.38 38.38 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -65.95 -13.41 59.72 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.562 1.545 . . . . 0.0 114.356 177.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -69.14 156.37 38.8 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.321 1.048 . . . . 0.0 112.784 172.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -128.99 171.17 12.61 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.538 1.935 . . . . 0.0 110.969 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.0 m -52.41 -32.55 39.58 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.025 1.33 . . . . 0.0 111.757 169.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.3 m -64.46 -43.23 94.88 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 173.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -66.48 -30.99 71.44 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.572 -0.705 . . . . 0.0 111.277 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 74.9 mt -70.15 -43.77 70.19 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.639 0.776 . . . . 0.0 111.408 173.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -58.5 -39.91 81.35 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 120.854 -1.154 . . . . 0.0 112.196 169.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -65.83 -34.51 78.31 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 119.126 0.875 . . . . 0.0 113.038 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 58.3 tp -70.64 -31.03 67.83 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.595 1.158 . . . . 0.0 113.056 176.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -117.22 6.03 12.74 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -171.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 78.2 p -57.67 -25.29 60.02 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 178.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.16 -15.65 15.82 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.549 1.54 . . . . 0.0 114.662 176.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -101.8 3.07 39.04 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.108 1.363 . . . . 0.0 114.069 -176.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.89 -48.72 4.1 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.906 1.717 . . . . 0.0 114.998 169.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -152.13 140.18 20.2 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.805 1.242 . . . . 0.0 111.113 176.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 30.5 pt -146.0 174.94 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.925 1.69 . . . . 0.0 111.842 -171.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 8.0 tm0? -139.91 139.54 36.22 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.978 1.311 . . . . 0.0 108.612 169.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 72.5 mt -120.84 130.07 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.879 1.272 . . . . 0.0 109.448 -175.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.3 m -134.78 99.61 4.37 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.335 1.454 . . . . 0.0 111.335 -176.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -57.4 152.26 14.74 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.768 1.227 . . . . 0.0 113.666 175.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 19.6 pt -134.15 -25.86 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.77 1.228 . . . . 0.0 113.173 169.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -156.0 179.32 9.33 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.048 1.339 . . . . 0.0 112.114 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.88 -14.09 60.84 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 -175.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 50.1 p -132.46 6.44 4.11 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.295 1.438 . . . . 0.0 113.603 -177.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 1.1 p -150.92 152.15 33.2 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 173.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -155.34 159.45 39.95 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.372 1.469 . . . . 0.0 111.87 -174.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.87 152.48 21.23 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.426 0.69 . . . . 0.0 110.769 168.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 59.6 t -137.21 116.25 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.954 1.301 . . . . 0.0 109.748 174.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 8.4 t -85.08 140.85 30.67 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.961 1.304 . . . . 0.0 110.53 172.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 60.9 mt -117.77 165.05 14.1 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.235 1.414 . . . . 0.0 111.548 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 9.4 t -62.97 -32.38 73.7 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.399 1.08 . . . . 0.0 113.864 -173.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -152.67 157.34 33.44 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.193 0.997 . . . . 0.0 112.919 175.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.13 -33.24 63.1 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.393 3.395 . . . . 0.0 115.517 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -58.21 -35.65 71.96 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -70.0 -23.4 63.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.405 1.082 . . . . 0.0 113.262 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 99.0 t -59.48 -44.22 92.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.155 1.382 . . . . 0.0 111.094 177.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -66.57 -34.95 79.05 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.594 0.758 . . . . 0.0 112.061 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 59.8 mt -64.96 -48.15 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.696 0.798 . . . . 0.0 110.212 176.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.95 -38.51 91.34 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.3 t -63.97 -40.22 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 121.31 -0.869 . . . . 0.0 111.361 173.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -61.09 -49.92 75.34 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.03 0.832 . . . . 0.0 112.201 172.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.0 p -67.3 -27.01 66.82 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -174.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 9.4 t -64.27 -19.7 65.57 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 171.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -60.78 -18.82 57.42 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.519 1.128 . . . . 0.0 113.147 172.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -117.33 7.69 12.92 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.858 1.663 . . . . 0.0 112.762 -175.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.22 156.97 30.14 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.27 1.428 . . . . 0.0 113.392 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -134.23 -12.26 2.47 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.773 1.229 . . . . 0.0 114.058 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 38.3 m -139.13 6.89 2.4 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.08 1.352 . . . . 0.0 113.744 -173.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -158.65 176.01 12.92 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.042 1.737 . . . . 0.0 111.31 -176.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . 0.456 HH22 ' NE2' ' A' ' 500' ' ' GLN . 50.1 ttp85 -147.27 145.79 29.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.581 1.952 . . . . 0.0 110.098 174.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 69.5 mt -130.77 141.97 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.738 1.615 . . . . 0.0 109.629 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . 0.456 ' NE2' HH22 ' A' ' 498' ' ' ARG . 24.0 pt20 -145.1 166.59 24.96 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.825 1.65 . . . . 0.0 110.924 171.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 52.0 p -71.72 163.24 28.15 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 120.756 -1.215 . . . . 0.0 112.378 174.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -58.69 -37.01 75.13 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.187 -0.946 . . . . 0.0 112.063 170.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.71 95.95 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.333 -0.854 . . . . 0.0 112.809 174.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -65.35 -32.68 74.45 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.348 -0.845 . . . . 0.0 112.977 173.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 73.2 t80 . . . . . 0 CA--C 1.539 0.532 0 CA-C-N 119.119 0.872 . . . . 0.0 111.427 169.586 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 . . . . . 0 N--CA 1.485 1.307 0 N-CA-C 113.874 1.065 . . . . 0.0 113.874 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.64 -15.42 63.64 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.649 -1.282 . . . . 0.0 113.578 176.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 -88.19 8.0 29.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.401 1.881 . . . . 0.0 114.08 172.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 40.7 t -110.86 148.58 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.092 1.357 . . . . 0.0 110.903 -173.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 94.5 mt -122.69 164.24 18.63 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.186 2.594 . . . . 0.0 110.522 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -126.75 139.12 53.37 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.461 1.905 . . . . 0.0 107.679 168.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.4 t -132.85 141.83 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.975 1.31 . . . . 0.0 109.226 -169.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.6 m -132.88 135.15 45.42 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.881 1.272 . . . . 0.0 109.753 -177.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -159.85 162.55 24.51 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 124.994 1.318 . . . . 0.0 111.719 -168.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.44 149.14 90.55 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.215 1.943 . . . . 0.0 110.909 168.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -18.54 13.71 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -57.34 -26.26 60.69 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.052 1.741 . . . . 0.0 113.979 173.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 19.7 m95 -64.65 154.4 36.56 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.001 0.921 . . . . 0.0 113.087 175.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -132.17 164.99 25.1 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.597 1.959 . . . . 0.0 111.129 177.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.9 m -53.29 -34.75 58.61 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.743 1.217 . . . . 0.0 112.156 173.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.2 m -65.36 -43.35 91.11 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.734 1.012 . . . . 0.0 113.734 175.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -64.81 -31.64 72.96 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.675 -0.64 . . . . 0.0 111.309 174.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.2 mt -71.05 -44.99 64.66 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.031 0.932 . . . . 0.0 111.551 175.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -57.22 -42.54 81.57 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.009 -1.057 . . . . 0.0 112.109 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -68.26 -29.07 67.79 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.458 1.103 . . . . 0.0 113.935 177.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.6 tp -69.5 -36.49 76.52 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.334 1.054 . . . . 0.0 112.316 173.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -110.96 -2.61 15.92 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -170.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 79.0 p -58.09 -19.66 33.8 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 176.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -57.41 -18.93 20.36 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.084 1.354 . . . . 0.0 114.133 170.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -100.18 2.71 43.2 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.743 1.617 . . . . 0.0 113.612 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 96.27 -159.67 21.97 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.011 1.291 . . . . 0.0 111.891 -171.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -64.24 150.37 46.06 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 121.838 -0.801 . . . . 0.0 111.25 169.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 5.5 pt -143.53 179.76 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 125.338 1.455 . . . . 0.0 111.655 -174.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -128.15 151.9 48.66 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.537 1.535 . . . . 0.0 110.699 170.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 60.3 mt -139.4 134.35 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.919 1.688 . . . . 0.0 108.972 -172.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.9 m -139.35 102.2 4.43 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.991 1.316 . . . . 0.0 111.384 -177.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -59.28 153.15 19.28 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 29.5 pt -134.9 -23.93 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.831 1.252 . . . . 0.0 113.416 169.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -153.7 174.38 14.59 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.353 1.061 . . . . 0.0 111.947 174.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -60.88 -15.09 26.82 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.601 1.96 . . . . 0.0 113.898 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 37.2 p -135.91 6.24 3.14 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.001 2.12 . . . . 0.0 113.448 -174.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 66.5 m -147.38 140.29 25.0 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.394 1.078 . . . . 0.0 113.218 -174.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.45 158.7 42.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.529 1.131 . . . . 0.0 112.49 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -89.04 153.29 21.12 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.753 0.821 . . . . 0.0 110.006 167.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 73.4 t -136.3 140.53 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.92 1.288 . . . . 0.0 109.091 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 43.0 m -124.97 116.09 21.61 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.206 1.403 . . . . 0.0 110.083 -169.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 47.1 mt -102.94 166.32 10.52 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.202 1.401 . . . . 0.0 111.176 -175.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 50.8 m -69.84 -26.75 64.37 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 -175.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -148.22 148.85 30.54 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 124.497 1.119 . . . . 0.0 112.348 -177.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -57.18 -26.02 67.37 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 123.5 2.8 . . . . 0.0 114.124 168.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -61.04 -33.54 73.46 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.064 -1.023 . . . . 0.0 112.56 172.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -76.46 -34.31 58.7 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.845 0.858 . . . . 0.0 111.799 174.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 22.4 t -57.54 -44.69 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.065 0.946 . . . . 0.0 111.354 170.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -58.97 -41.04 86.58 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.133 0.573 . . . . 0.0 112.378 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 91.0 mt -66.87 -45.76 86.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.634 0.773 . . . . 0.0 110.938 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.1 -34.32 76.1 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 119.324 0.965 . . . . 0.0 113.466 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 60.4 t -65.73 -43.84 93.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 O-C-N 121.296 -0.878 . . . . 0.0 111.003 170.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -60.5 -45.06 95.16 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.922 0.783 . . . . 0.0 112.729 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 46.0 p -71.64 -27.4 63.06 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -177.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 24.8 p -63.21 -19.05 64.17 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 59.1 mtmt -60.96 -18.38 56.95 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.254 1.422 . . . . 0.0 113.963 173.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -119.06 1.4 11.41 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.064 1.345 . . . . 0.0 113.211 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -68.19 152.78 44.96 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.669 1.188 . . . . 0.0 112.469 173.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -132.27 -4.9 3.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.818 1.247 . . . . 0.0 114.044 -177.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 22.6 m -136.52 5.9 2.96 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.322 1.449 . . . . 0.0 113.413 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -161.04 171.52 18.47 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.039 2.135 . . . . 0.0 110.173 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -147.79 156.88 43.2 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.122 1.369 . . . . 0.0 111.06 169.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 69.3 mt -133.49 146.38 32.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.766 1.626 . . . . 0.0 109.572 -174.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -142.11 161.78 37.15 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.98 1.712 . . . . 0.0 109.679 168.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 26.3 p -71.89 162.29 29.67 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.702 -1.249 . . . . 0.0 111.888 173.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -60.39 -33.41 72.44 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.161 -0.962 . . . . 0.0 111.953 169.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.91 -38.02 89.58 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.299 -0.875 . . . . 0.0 113.111 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -67.78 -39.67 84.07 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.09 -1.006 . . . . 0.0 112.144 172.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 62.0 t80 . . . . . 0 CA--C 1.545 0.777 0 C-N-CA 124.247 1.019 . . . . 0.0 112.288 174.175 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.924 0 CA-C-O 121.563 0.697 . . . . 0.0 112.398 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -156.13 -43.07 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.816 2.046 . . . . 0.0 109.729 170.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 -70.26 38.19 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.132 2.973 . . . . 0.0 112.941 168.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 46.3 t -128.07 126.11 65.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 125.005 1.322 . . . . 0.0 111.027 -168.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 83.8 mt -92.68 168.31 11.31 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.423 1.889 . . . . 0.0 111.723 174.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 41.2 t-80 -128.19 136.23 50.81 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.43 2.292 . . . . 0.0 106.928 166.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 10.7 t -132.77 136.02 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.602 1.161 . . . . 0.0 109.091 -171.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 16.5 m -124.82 135.51 53.0 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.109 1.364 . . . . 0.0 109.689 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -156.2 156.51 30.39 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 124.487 1.115 . . . . 0.0 112.671 -169.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.22 150.96 30.54 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.813 3.009 . . . . 0.0 112.644 168.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -56.18 -22.19 27.49 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -62.09 -27.66 69.07 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.456 1.503 . . . . 0.0 113.512 176.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -68.54 150.2 48.32 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.118 0.967 . . . . 0.0 112.968 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 36.0 mttm -135.08 174.29 10.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.366 1.866 . . . . 0.0 112.145 176.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.4 m -48.36 -36.35 14.35 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.026 1.73 . . . . 0.0 112.713 173.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.8 m -64.63 -45.33 87.27 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 175.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -63.49 -30.93 71.98 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.369 0.668 . . . . 0.0 111.416 175.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 73.6 mt -71.02 -46.62 61.82 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.821 0.849 . . . . 0.0 111.639 175.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -61.95 -31.11 71.42 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.639 -1.288 . . . . 0.0 113.422 171.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -72.65 -34.65 67.41 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.442 1.097 . . . . 0.0 113.26 172.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 65.2 tp -64.5 -30.61 71.64 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.469 1.108 . . . . 0.0 112.253 172.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -115.64 22.95 12.72 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.95 1.3 . . . . 0.0 113.938 -175.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 92.1 p -59.12 -21.61 59.57 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.309 1.043 . . . . 0.0 113.796 172.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -61.73 -19.2 62.16 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.505 1.522 . . . . 0.0 114.047 169.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -115.05 -39.39 3.66 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.389 1.475 . . . . 0.0 111.483 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 65.36 7.98 35.49 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 125.707 1.622 . . . . 0.0 117.06 169.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -143.06 17.61 1.93 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.194 1.398 . . . . 0.0 112.886 -170.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 19.5 pt -64.83 171.37 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 125.636 1.574 . . . . 0.0 113.577 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -134.55 144.05 47.75 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.301 1.441 . . . . 0.0 109.16 169.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 86.4 mt -121.63 133.97 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.154 0.982 . . . . 0.0 109.943 -169.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 71.2 m -134.82 97.03 3.66 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.138 1.775 . . . . 0.0 109.938 -176.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -57.86 158.32 6.61 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 8.9 mt -132.89 -42.93 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.974 1.309 . . . . 0.0 109.537 177.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -155.16 -179.03 7.68 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.461 1.504 . . . . 0.0 111.85 173.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -59.61 -16.16 23.81 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.805 1.642 . . . . 0.0 114.831 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 67.6 p -132.23 3.0 3.95 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.052 1.741 . . . . 0.0 114.577 -173.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 3.6 p -151.8 153.99 35.34 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 170.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -150.83 155.03 38.37 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.924 1.29 . . . . 0.0 112.353 -177.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -89.5 148.11 23.6 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.045 0.938 . . . . 0.0 109.517 167.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 56.4 t -138.61 111.24 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.956 0.902 . . . . 0.0 110.652 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 74.0 m -77.42 139.43 39.68 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.333 1.453 . . . . 0.0 111.44 174.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 52.1 mt -110.82 170.8 7.86 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.424 1.49 . . . . 0.0 111.625 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 61.9 m -77.97 -26.04 48.48 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -144.93 148.74 40.04 Favored Pre-proline 0 CA--C 1.544 0.734 0 C-N-CA 125.144 1.378 . . . . 0.0 111.207 178.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -55.1 -29.56 66.29 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.682 2.921 . . . . 0.0 114.551 171.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -59.89 -36.16 76.37 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.524 1.13 . . . . 0.0 113.1 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -67.28 -20.9 65.71 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.458 1.103 . . . . 0.0 113.252 -178.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 96.9 t -60.42 -44.43 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.241 1.016 . . . . 0.0 111.01 176.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -68.03 -35.42 78.24 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.721 0.808 . . . . 0.0 111.497 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 68.2 mt -61.79 -48.29 89.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.813 0.845 . . . . 0.0 110.453 176.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.8 82.31 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 72.0 t -65.9 -41.43 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 O-C-N 121.134 -0.979 . . . . 0.0 111.209 171.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -62.43 -32.31 73.14 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.148 0.979 . . . . 0.0 113.271 176.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 39.4 p -86.24 -27.52 24.4 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.019 0.928 . . . . 0.0 113.086 178.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 11.2 t -69.58 -24.05 63.63 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -60.67 -19.31 58.11 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -90.16 -10.34 44.89 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.305 1.442 . . . . 0.0 114.066 176.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -68.92 152.53 45.16 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.204 1.002 . . . . 0.0 113.535 -173.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -140.61 2.93 1.85 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.222 1.409 . . . . 0.0 113.864 175.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 77.4 p -135.84 1.07 2.74 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.271 1.828 . . . . 0.0 113.742 -177.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -156.34 175.04 14.53 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.425 2.29 . . . . 0.0 109.591 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 46.3 ttm180 -147.04 146.84 30.15 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.031 1.332 . . . . 0.0 110.984 175.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 48.3 mt -129.27 139.48 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.972 1.709 . . . . 0.0 109.055 175.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -147.57 171.27 15.84 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.449 1.9 . . . . 0.0 109.829 173.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 19.0 p -72.86 164.01 27.26 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 120.334 -1.479 . . . . 0.0 112.319 172.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -52.85 -44.6 66.88 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.523 0.729 . . . . 0.0 111.518 168.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -69.14 -35.25 76.17 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -63.58 -43.72 96.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.168 0.895 . . . . 0.0 111.965 173.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 75.9 t80 . . . . . 0 CA--C 1.537 0.471 0 C-N-CA 123.005 0.522 . . . . 0.0 111.773 174.208 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 112.875 0.695 . . . . 0.0 112.875 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -60.37 -25.96 66.27 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 120.801 -1.187 . . . . 0.0 113.791 178.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -92.82 18.94 8.17 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.484 1.914 . . . . 0.0 113.737 176.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 24.6 t -125.85 147.44 30.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.773 1.229 . . . . 0.0 111.98 -169.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 74.3 mt -118.45 164.08 15.79 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.568 2.347 . . . . 0.0 110.849 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -122.87 139.2 54.28 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 126.783 2.033 . . . . 0.0 107.772 168.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.0 t -131.34 142.11 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.855 1.262 . . . . 0.0 109.345 -169.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.54 136.16 50.38 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.458 1.503 . . . . 0.0 109.581 -178.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -160.08 157.88 25.69 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 123.598 0.759 . . . . 0.0 112.963 -170.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.65 145.75 68.86 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.757 2.971 . . . . 0.0 112.499 168.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -55.69 -24.59 35.27 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 -176.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -67.1 -17.63 64.96 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.985 1.314 . . . . 0.0 114.162 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -62.63 155.08 27.16 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.094 0.958 . . . . 0.0 112.979 173.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -139.53 165.79 26.29 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.528 1.931 . . . . 0.0 110.674 -173.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.7 m -57.03 -32.48 66.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.115 0.966 . . . . 0.0 111.763 176.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 43.6 m -66.58 -42.03 87.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 173.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -65.79 -31.71 72.83 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.438 -0.789 . . . . 0.0 111.248 174.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.4 mt -70.68 -44.92 66.0 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.861 0.864 . . . . 0.0 111.501 174.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -57.51 -38.2 74.26 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.091 -1.006 . . . . 0.0 112.407 169.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -68.29 -40.36 81.8 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.98 0.809 . . . . 0.0 112.999 175.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.0 tp -64.32 -36.02 82.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.842 1.257 . . . . 0.0 112.273 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -106.84 10.42 30.68 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.569 1.148 . . . . 0.0 113.419 -176.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 22.2 t -55.81 -31.74 62.93 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.664 1.586 . . . . 0.0 113.791 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.84 -15.23 11.5 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.443 1.497 . . . . 0.0 115.021 178.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -101.63 -0.52 34.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.888 1.275 . . . . 0.0 114.11 -176.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 77.31 -41.73 1.85 Allowed Glycine 0 CA--C 1.536 1.399 0 C-N-CA 126.086 1.803 . . . . 0.0 116.101 169.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -148.59 130.81 15.5 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.282 1.433 . . . . 0.0 110.673 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 18.7 pt -145.92 174.73 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.435 1.494 . . . . 0.0 111.478 -172.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.88 146.82 41.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.813 1.245 . . . . 0.0 109.001 168.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 67.9 mt -127.78 130.07 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.032 1.333 . . . . 0.0 109.222 -174.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 51.8 m -136.85 94.74 3.01 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.195 1.398 . . . . 0.0 111.022 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -55.83 154.33 7.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.701 1.2 . . . . 0.0 113.633 176.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 17.7 pt -132.27 -28.97 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.474 1.109 . . . . 0.0 113.617 170.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -160.15 -175.16 4.91 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.917 1.287 . . . . 0.0 112.44 172.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -57.89 -22.0 46.17 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 -177.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.6 p -134.2 5.33 3.53 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.938 1.295 . . . . 0.0 113.979 -171.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 60.9 m -143.56 147.92 35.16 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.705 1.202 . . . . 0.0 113.295 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.26 156.23 39.29 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.299 1.44 . . . . 0.0 111.753 175.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -89.9 151.57 21.67 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.557 0.743 . . . . 0.0 110.18 168.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.5 t -137.98 115.9 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.496 1.118 . . . . 0.0 110.325 176.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 16.3 m -83.62 140.64 32.08 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.074 1.35 . . . . 0.0 110.673 172.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 80.4 mt -123.18 147.04 47.28 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.769 1.227 . . . . 0.0 110.2 176.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 5.2 m -65.8 -16.01 63.41 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 115.767 1.766 . . . . 0.0 115.767 -172.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -140.25 148.09 52.75 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 124.562 1.145 . . . . 0.0 111.429 175.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -70.0 -20.75 33.29 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.105 2.537 . . . . 0.0 113.579 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -66.59 -32.61 74.06 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.825 -1.172 . . . . 0.0 112.346 172.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -67.29 -31.2 71.35 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.163 0.985 . . . . 0.0 112.189 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.2 t -58.64 -46.42 90.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.242 1.417 . . . . 0.0 110.741 173.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -63.86 -41.92 97.66 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.501 0.72 . . . . 0.0 112.031 176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 94.6 mt -63.1 -42.55 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.579 0.752 . . . . 0.0 111.292 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.41 -39.72 95.26 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.114 -0.991 . . . . 0.0 113.094 176.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 69.2 t -66.16 -42.02 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 O-C-N 121.218 -0.926 . . . . 0.0 111.347 172.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -61.22 -37.66 83.84 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.121 0.968 . . . . 0.0 113.116 176.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 22.0 p -83.32 -28.87 28.74 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.556 1.142 . . . . 0.0 113.237 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 8.7 t -60.78 -19.38 59.23 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 171.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -51.77 -26.54 9.84 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.703 1.601 . . . . 0.0 113.661 169.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -114.9 10.15 16.31 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.606 1.562 . . . . 0.0 113.093 -174.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -64.71 156.56 29.97 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.931 1.293 . . . . 0.0 113.095 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.55 -5.46 1.21 Allowed 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 176.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 51.0 m -137.31 5.08 2.71 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.392 1.477 . . . . 0.0 113.629 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 49.5 p90 -157.92 176.07 13.02 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.241 1.816 . . . . 0.0 111.208 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 69.5 ttt-85 -147.34 145.21 29.24 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.003 2.121 . . . . 0.0 109.997 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 79.2 mt -132.5 141.61 44.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.434 1.494 . . . . 0.0 109.841 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -143.12 163.82 31.81 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.109 1.764 . . . . 0.0 110.509 169.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 65.1 p -73.02 161.51 30.59 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.753 -1.217 . . . . 0.0 112.347 174.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -60.42 -34.15 73.54 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.206 -0.934 . . . . 0.0 111.591 168.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -63.88 -37.82 88.81 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.447 -0.783 . . . . 0.0 113.09 174.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -66.52 -42.36 87.41 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.13 -0.982 . . . . 0.0 112.168 170.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 57.1 t80 . . . . . 0 CA--C 1.541 0.622 0 CA-C-N 118.777 0.717 . . . . 0.0 111.422 173.648 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 . . . . . 0 N--CA 1.485 1.308 0 N-CA-C 113.917 1.081 . . . . 0.0 113.917 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -63.35 -22.8 67.1 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 121.087 -1.008 . . . . 0.0 113.543 176.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -90.32 15.36 10.66 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.757 2.023 . . . . 0.0 113.93 175.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 42.5 t -117.59 141.78 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.929 1.292 . . . . 0.0 111.182 -173.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 93.7 mt -108.16 163.58 13.05 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 126.819 2.048 . . . . 0.0 111.489 176.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -122.53 136.19 54.83 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.699 2.0 . . . . 0.0 107.026 166.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 4.8 t -132.27 138.59 52.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 124.893 1.277 . . . . 0.0 109.088 -169.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.2 m -129.55 136.17 49.49 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.924 1.29 . . . . 0.0 109.529 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -158.85 155.96 25.8 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.404 1.082 . . . . 0.0 112.538 -169.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.13 144.85 78.86 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.5 2.8 . . . . 0.0 111.418 167.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 7.2 ptpt -59.59 -19.14 46.72 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -176.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.43 -21.77 66.49 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.696 1.598 . . . . 0.0 114.016 172.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -63.36 150.94 42.21 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.002 0.819 . . . . 0.0 112.276 172.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -130.73 169.1 16.14 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.329 1.852 . . . . 0.0 111.634 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.5 m -50.92 -34.46 28.63 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.652 1.181 . . . . 0.0 112.513 171.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 43.2 m -66.19 -40.18 90.24 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -66.82 -31.97 72.93 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.608 -0.683 . . . . 0.0 111.168 173.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 90.8 mt -70.56 -41.38 72.52 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.615 0.766 . . . . 0.0 111.485 174.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -60.55 -42.22 96.12 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.959 -1.088 . . . . 0.0 111.634 169.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.3 tt0 -60.78 -33.91 73.68 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.122 -0.986 . . . . 0.0 112.681 175.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 44.9 tp -79.49 -27.23 41.48 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.849 1.26 . . . . 0.0 114.105 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -128.76 -17.5 4.02 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 116.888 2.181 . . . . 0.0 116.888 -168.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 14.8 t -60.87 -21.8 63.63 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.63 1.559 . . . . 0.0 113.43 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -54.36 -24.32 19.01 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.413 1.485 . . . . 0.0 114.521 171.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -80.46 -1.23 40.75 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 99.77 -44.67 1.61 Allowed Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.705 1.622 . . . . 0.0 114.541 168.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -152.69 136.91 16.54 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.12 1.368 . . . . 0.0 110.391 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 29.1 pt -144.42 171.79 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.679 1.191 . . . . 0.0 112.298 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -143.89 145.82 32.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.133 1.373 . . . . 0.0 109.146 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 77.0 mt -127.15 128.71 70.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.752 1.221 . . . . 0.0 109.158 -172.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 46.3 m -136.18 99.38 4.11 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.455 1.502 . . . . 0.0 111.071 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -58.42 151.1 20.74 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.196 0.998 . . . . 0.0 113.63 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 38.2 pt -133.59 -19.84 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.778 1.231 . . . . 0.0 113.278 169.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -152.0 178.19 9.69 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.743 1.217 . . . . 0.0 111.713 172.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -66.17 -14.66 62.21 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.158 1.783 . . . . 0.0 112.926 174.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.0 p -134.64 5.03 3.39 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.598 1.959 . . . . 0.0 113.718 -172.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 88.0 p -155.05 154.9 33.16 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.39 161.5 42.25 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.663 1.585 . . . . 0.0 112.088 -177.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -93.48 149.66 21.06 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.982 0.913 . . . . 0.0 110.054 167.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.2 t -138.3 114.91 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.174 0.99 . . . . 0.0 110.746 177.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 19.3 m -77.61 141.21 39.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.835 1.254 . . . . 0.0 111.066 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 70.7 mt -121.08 165.62 15.07 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.42 1.488 . . . . 0.0 110.621 171.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 55.0 m -63.67 -29.66 70.86 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -146.47 152.4 45.71 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.628 1.171 . . . . 0.0 112.385 -176.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.37 -17.23 39.45 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.329 2.686 . . . . 0.0 113.497 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -63.23 -35.61 80.9 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.616 -1.303 . . . . 0.0 111.539 169.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -74.96 -30.57 61.25 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.125 0.97 . . . . 0.0 112.356 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 13.5 t -57.02 -44.96 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.008 0.923 . . . . 0.0 111.173 171.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -60.81 -41.27 95.34 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.107 0.563 . . . . 0.0 112.272 176.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 98.8 mt -61.43 -50.64 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.806 0.842 . . . . 0.0 110.668 176.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.87 -36.54 83.64 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 78.3 t -65.75 -41.16 89.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 121.117 -0.989 . . . . 0.0 111.242 171.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -63.2 -43.84 97.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.795 0.725 . . . . 0.0 112.832 176.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 35.3 p -68.86 -27.82 66.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.708 0.803 . . . . 0.0 113.068 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.3 t -65.53 -18.24 65.18 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 174.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -60.29 -14.32 17.52 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.702 1.201 . . . . 0.0 114.043 176.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -128.95 13.29 6.27 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.076 1.75 . . . . 0.0 112.609 -176.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.05 159.21 23.69 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.997 1.319 . . . . 0.0 113.044 175.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -138.06 -0.99 2.01 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -178.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 8.7 t -145.03 4.74 1.1 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.218 1.407 . . . . 0.0 113.006 -178.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -159.27 174.85 14.16 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.378 1.471 . . . . 0.0 111.637 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 79.2 ttt-85 -145.01 147.82 33.05 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.386 1.874 . . . . 0.0 110.313 169.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 68.4 mt -129.1 141.45 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.336 1.855 . . . . 0.0 109.611 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -144.52 166.07 26.2 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.932 1.693 . . . . 0.0 109.728 169.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 25.7 p -71.79 162.28 29.68 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.696 -1.252 . . . . 0.0 111.677 175.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -57.09 -39.19 74.52 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.278 -0.889 . . . . 0.0 111.829 168.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.76 -36.97 86.02 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -67.33 -40.96 85.95 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.171 -0.956 . . . . 0.0 112.145 173.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 71.3 t80 . . . . . 0 CA--C 1.54 0.584 0 CA-C-N 118.42 0.555 . . . . 0.0 111.476 172.605 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 73.4 mtt180 . . . . . 0 N--CA 1.483 1.219 0 N-CA-C 116.077 1.881 . . . . 0.0 116.077 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.29 -15.57 57.64 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 -96.27 13.79 26.36 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.909 2.084 . . . . 0.0 113.695 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 55.4 t -128.0 143.5 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.915 1.286 . . . . 0.0 111.777 -171.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 72.1 mt -107.16 166.3 10.73 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 127.342 2.257 . . . . 0.0 111.496 175.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 22.8 t-80 -121.53 137.55 54.68 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.974 2.11 . . . . 0.0 107.103 166.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 13.4 t -133.81 139.72 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.877 1.271 . . . . 0.0 108.958 -169.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.0 m -128.72 132.52 47.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.193 1.397 . . . . 0.0 109.252 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -151.49 159.71 32.93 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.444 1.098 . . . . 0.0 112.895 -168.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -52.15 150.15 19.96 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.19 3.26 . . . . 0.0 114.058 170.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.0 pttm -53.67 -28.05 31.1 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.456 1.503 . . . . 0.0 115.048 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -81.55 -12.91 58.63 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.406 1.483 . . . . 0.0 114.212 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 7.6 m0 -65.63 152.8 43.31 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.305 0.957 . . . . 0.0 112.982 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -129.72 168.93 15.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.403 1.881 . . . . 0.0 111.832 -178.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.2 m -48.53 -35.45 13.29 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.444 1.498 . . . . 0.0 112.213 169.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 70.8 m -64.41 -43.72 93.5 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -64.54 -33.18 75.32 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.751 -0.593 . . . . 0.0 111.147 174.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.92 -44.57 65.91 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.87 0.868 . . . . 0.0 111.792 176.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.38 -43.42 92.91 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.166 -0.959 . . . . 0.0 112.018 169.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -61.43 -32.21 72.17 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.923 0.783 . . . . 0.0 112.977 175.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 52.7 tp -74.83 -34.3 62.31 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.499 1.12 . . . . 0.0 113.254 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -116.53 -5.88 11.69 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -169.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 87.1 p -57.62 -22.88 48.0 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 114.549 1.315 . . . . 0.0 114.549 175.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.4 -21.62 51.21 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.063 1.345 . . . . 0.0 114.17 173.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -94.24 -5.89 45.86 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.157 1.383 . . . . 0.0 113.779 177.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 109.69 -154.07 16.68 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 125.071 1.319 . . . . 0.0 112.213 -173.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -61.37 153.61 26.34 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.652 0.781 . . . . 0.0 112.13 169.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 33.0 pt -142.54 176.92 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 125.389 1.476 . . . . 0.0 111.795 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -143.82 146.16 32.87 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.2 1.4 . . . . 0.0 108.926 169.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 77.8 mt -129.48 133.28 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.679 1.192 . . . . 0.0 109.289 -172.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 39.5 m -134.78 97.38 3.76 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.742 1.617 . . . . 0.0 110.497 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -60.01 153.29 21.79 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.731 1.212 . . . . 0.0 113.955 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 28.9 pt -133.44 -24.47 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.817 1.247 . . . . 0.0 112.9 169.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -149.75 173.18 14.0 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.748 1.619 . . . . 0.0 112.064 173.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.81 -20.48 50.6 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.557 1.543 . . . . 0.0 113.66 169.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.4 p -126.58 0.93 6.86 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.046 1.738 . . . . 0.0 114.197 -172.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 36.3 p -154.4 151.26 28.8 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 174.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.87 160.58 43.08 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.617 1.567 . . . . 0.0 111.96 -176.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -89.13 149.76 23.02 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.448 0.699 . . . . 0.0 110.341 167.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 48.5 t -138.53 119.15 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 124.564 1.146 . . . . 0.0 110.773 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 14.1 t -80.99 144.52 31.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.191 1.396 . . . . 0.0 111.881 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 86.0 mt -129.66 155.6 45.61 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.737 1.615 . . . . 0.0 110.871 174.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 48.9 m -68.85 -24.17 64.33 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -169.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -137.99 151.45 70.12 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.75 1.22 . . . . 0.0 111.527 172.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -67.97 -18.63 46.42 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.262 2.641 . . . . 0.0 113.744 174.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.17 -37.93 89.24 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.662 -1.274 . . . . 0.0 111.98 170.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.3 -32.94 74.26 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.405 -0.81 . . . . 0.0 112.092 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.8 t -58.93 -47.28 90.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.79 1.236 . . . . 0.0 110.506 172.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -62.48 -42.87 99.79 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.571 -0.706 . . . . 0.0 112.211 176.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 87.4 mt -62.76 -43.81 99.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 123.76 0.824 . . . . 0.0 111.368 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.1 -38.56 91.68 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.324 -0.86 . . . . 0.0 113.069 177.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 71.1 t -66.76 -42.47 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 121.283 -0.886 . . . . 0.0 111.364 173.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -60.79 -44.44 96.8 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.032 0.833 . . . . 0.0 112.661 176.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 26.1 p -74.69 -21.74 59.23 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.224 1.009 . . . . 0.0 113.649 -178.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 21.2 p -65.2 -15.17 62.17 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 175.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -56.41 -15.14 3.64 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.671 1.588 . . . . 0.0 114.122 172.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -126.93 16.04 7.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.286 1.834 . . . . 0.0 112.333 -174.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.51 -36.75 84.77 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -174.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 52.68 -18.65 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 129.751 3.22 . . . . 0.0 118.906 -175.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 50.2 m -135.48 1.36 2.86 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.226 1.411 . . . . 0.0 114.371 -173.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -155.58 176.14 12.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.183 2.193 . . . . 0.0 109.56 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -144.6 150.26 37.15 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.289 1.036 . . . . 0.0 111.767 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 78.2 mt -135.66 144.11 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 126.083 1.753 . . . . 0.0 109.5 -177.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -147.54 168.63 21.47 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.148 1.779 . . . . 0.0 110.376 169.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 18.6 p -71.65 163.59 27.48 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 120.659 -1.276 . . . . 0.0 111.702 172.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -55.35 -42.06 73.35 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.272 -0.892 . . . . 0.0 112.308 169.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.25 92.94 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.653 0.781 . . . . 0.0 112.868 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.45 -31.9 72.4 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.442 -0.786 . . . . 0.0 112.66 175.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 39.4 t80 . . . . . 0 CA--C 1.54 0.586 0 CA-C-N 119.063 0.847 . . . . 0.0 111.415 169.016 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 . . . . . 0 N--CA 1.484 1.273 0 N-CA-C 115.696 1.739 . . . . 0.0 115.696 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -66.91 -17.01 64.7 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.246 1.419 . . . . 0.0 113.234 169.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -95.2 14.67 21.42 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.899 2.08 . . . . 0.0 113.386 175.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 39.8 t -122.19 142.9 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 124.856 1.263 . . . . 0.0 111.583 -170.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 76.5 mt -114.12 164.35 13.97 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 127.328 2.251 . . . . 0.0 110.868 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -120.95 140.24 52.14 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.875 2.07 . . . . 0.0 107.772 168.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.5 t -133.62 142.79 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 C-N-CA 124.776 1.23 . . . . 0.0 109.15 -169.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 12.2 m -132.27 134.05 44.82 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.215 1.406 . . . . 0.0 109.581 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -158.55 157.32 28.6 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.293 1.037 . . . . 0.0 112.561 -169.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.83 144.17 78.24 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 123.53 2.82 . . . . 0.0 112.179 168.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -55.2 -24.27 26.3 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.44 -13.96 54.32 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.247 1.419 . . . . 0.0 114.554 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -68.99 156.0 39.37 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.5 1.12 . . . . 0.0 112.877 172.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -129.16 170.11 13.95 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.381 1.872 . . . . 0.0 111.058 174.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.1 m -51.81 -33.53 36.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.788 1.235 . . . . 0.0 111.943 169.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.3 m -64.83 -42.3 95.07 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 175.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -66.31 -31.8 72.81 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.626 -0.671 . . . . 0.0 111.094 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.2 mt -70.98 -43.02 68.92 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.78 0.832 . . . . 0.0 111.395 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -57.47 -44.1 84.6 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.926 -1.109 . . . . 0.0 111.511 169.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -62.45 -33.51 74.96 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 50.7 tp -73.93 -29.72 62.18 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.444 1.098 . . . . 0.0 113.412 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -120.38 -4.39 9.9 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.947 1.832 . . . . 0.0 115.947 -169.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 86.5 p -59.42 -20.24 53.46 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 173.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -60.77 -9.19 3.68 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.923 1.689 . . . . 0.0 114.87 172.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -119.28 14.97 13.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.745 1.618 . . . . 0.0 113.398 -172.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 89.31 -149.41 20.67 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.484 1.04 . . . . 0.0 112.704 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -62.58 142.55 57.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.482 0.713 . . . . 0.0 111.281 170.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 38.5 pt -142.57 174.16 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.489 1.515 . . . . 0.0 111.698 -176.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -138.79 142.37 38.74 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.897 1.279 . . . . 0.0 109.044 168.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 69.8 mt -122.33 124.89 71.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 125.067 1.347 . . . . 0.0 108.471 -176.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 75.7 m -135.25 94.83 3.18 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.416 1.486 . . . . 0.0 110.904 -169.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 86.7 m95 -56.27 152.72 10.6 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.325 1.05 . . . . 0.0 113.648 178.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 27.4 pt -129.88 -22.59 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 124.707 1.203 . . . . 0.0 113.206 170.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.43 -174.12 3.88 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.713 2.005 . . . . 0.0 110.233 169.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -74.08 -5.32 40.91 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -176.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 69.5 p -135.44 2.15 2.95 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 119.757 1.162 . . . . 0.0 114.064 -177.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 45.5 m -144.51 150.57 37.79 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.411 1.485 . . . . 0.0 113.295 173.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.6 156.89 41.37 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.195 1.398 . . . . 0.0 111.588 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -89.87 151.1 21.92 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.492 0.717 . . . . 0.0 109.874 167.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 63.1 t -138.34 114.53 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 124.137 0.975 . . . . 0.0 110.536 176.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 32.5 m -79.32 138.93 37.9 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.687 1.195 . . . . 0.0 110.533 171.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 56.1 mt -113.81 164.49 13.67 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.526 1.13 . . . . 0.0 111.703 175.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 22.7 t -55.49 -40.96 72.37 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.478 1.111 . . . . 0.0 113.452 -175.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -146.51 160.86 40.48 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.324 1.85 . . . . 0.0 110.982 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.88 -12.45 30.79 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.334 2.689 . . . . 0.0 114.074 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -61.53 -38.91 89.15 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.983 -1.073 . . . . 0.0 112.445 173.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -76.54 -20.4 56.91 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.069 0.948 . . . . 0.0 113.309 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.42 -44.58 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 124.653 1.181 . . . . 0.0 110.59 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -61.91 -40.47 95.58 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.698 0.799 . . . . 0.0 112.183 174.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 57.0 mt -65.12 -45.7 93.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.482 0.713 . . . . 0.0 110.843 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.5 -36.0 82.33 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 177.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 79.0 t -65.52 -40.93 89.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 120.987 -1.07 . . . . 0.0 110.992 170.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -63.13 -39.96 96.19 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.847 0.859 . . . . 0.0 113.156 176.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 44.2 p -76.68 -31.05 57.01 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.798 0.839 . . . . 0.0 112.842 -178.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.2 t -61.17 -19.58 61.74 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 173.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -54.16 -22.63 11.75 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.539 1.535 . . . . 0.0 113.54 169.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -122.73 10.38 9.63 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.903 1.681 . . . . 0.0 113.144 -175.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -66.45 157.33 32.29 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.513 1.125 . . . . 0.0 112.83 175.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.43 -5.1 1.24 Allowed 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 50.6 m -135.55 4.47 3.11 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.347 1.459 . . . . 0.0 113.468 -178.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.9 p90 -161.59 175.18 12.35 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.096 2.158 . . . . 0.0 110.213 -177.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 54.9 ttt85 -147.44 151.75 36.95 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.442 1.497 . . . . 0.0 111.17 169.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 49.3 mt -132.46 142.29 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 126.019 1.727 . . . . 0.0 110.091 -175.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.7 pt20 -145.34 171.43 14.61 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.304 1.841 . . . . 0.0 110.137 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 44.7 p -72.18 160.85 31.75 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 120.481 -1.387 . . . . 0.0 112.325 174.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -55.29 -43.01 74.37 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.5 -0.75 . . . . 0.0 111.565 168.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.75 -38.05 89.68 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.888 0.875 . . . . 0.0 113.31 179.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.04 -45.54 93.12 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.424 -0.798 . . . . 0.0 112.072 173.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 89.2 t80 . . . . . 0 CA--C 1.538 0.511 0 CA-C-N 118.51 0.595 . . . . 0.0 111.817 174.977 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 86.9 mmt-85 . . . . . 0 N--CA 1.488 1.425 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -67.35 -2.72 6.56 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 177.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 37.2 p-80 -117.3 12.86 14.45 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.322 1.849 . . . . 0.0 113.06 175.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 45.2 t -116.43 125.81 73.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.635 1.174 . . . . 0.0 111.849 -169.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.72 167.97 11.31 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.91 1.684 . . . . 0.0 111.693 169.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -128.13 136.68 51.48 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 127.052 2.141 . . . . 0.0 106.806 166.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 11.6 t -132.98 136.86 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.606 1.163 . . . . 0.0 109.131 -169.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 19.0 m -125.89 134.1 51.7 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.055 1.342 . . . . 0.0 109.423 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.9 p90 -156.78 156.98 30.58 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 124.362 1.065 . . . . 0.0 112.462 -168.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.24 145.22 67.18 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.548 2.832 . . . . 0.0 112.193 168.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -55.71 -22.96 26.17 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.362 1.615 . . . . 0.0 115.362 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.71 -12.86 61.42 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.398 1.479 . . . . 0.0 114.329 177.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -70.34 156.31 39.48 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.371 1.068 . . . . 0.0 113.115 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -131.82 170.23 15.13 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.387 1.875 . . . . 0.0 111.727 174.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.3 m -48.17 -37.84 16.63 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.199 1.8 . . . . 0.0 111.857 169.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.7 m -62.31 -45.25 94.07 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -64.56 -30.7 71.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.264 0.626 . . . . 0.0 111.529 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 77.1 mt -72.82 -46.45 53.05 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.853 0.861 . . . . 0.0 111.867 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -61.82 -31.9 72.17 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.774 -1.204 . . . . 0.0 112.809 170.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -69.9 -35.82 74.92 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.095 0.862 . . . . 0.0 112.787 172.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.1 -32.74 74.6 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.754 1.222 . . . . 0.0 112.251 175.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -114.02 13.41 18.19 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 -174.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 90.6 p -56.91 -26.37 59.01 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 178.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.48 -21.96 60.87 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.312 1.445 . . . . 0.0 114.466 174.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -92.98 -2.44 55.75 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.785 1.234 . . . . 0.0 113.703 177.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 78.84 -45.21 2.68 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 125.911 1.72 . . . . 0.0 114.248 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -145.54 151.31 37.94 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.649 1.58 . . . . 0.0 111.416 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 19.9 pt -149.36 178.94 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 127.28 2.232 . . . . 0.0 110.258 173.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -141.96 144.61 33.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.152 1.381 . . . . 0.0 109.007 167.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 66.0 mt -123.79 137.55 56.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.897 0.879 . . . . 0.0 110.585 -169.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 69.5 m -135.17 95.28 3.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.184 1.794 . . . . 0.0 109.932 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -58.86 152.25 19.74 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.996 0.919 . . . . 0.0 113.233 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 39.2 pt -134.74 -20.94 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.679 1.192 . . . . 0.0 113.524 172.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -153.32 175.6 12.92 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.649 1.179 . . . . 0.0 111.686 173.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -64.8 -13.34 55.21 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.803 1.641 . . . . 0.0 113.569 174.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 42.0 p -133.97 3.16 3.44 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.684 1.594 . . . . 0.0 113.928 -174.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 51.8 p -154.86 157.24 37.54 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 171.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.29 157.2 39.77 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.542 1.537 . . . . 0.0 111.831 -175.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -89.83 149.26 22.75 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.457 0.703 . . . . 0.0 110.176 167.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 42.6 t -138.17 111.12 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 124.135 0.974 . . . . 0.0 110.57 -179.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 58.5 m -75.81 139.05 41.56 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.355 1.462 . . . . 0.0 111.059 171.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 45.7 mt -113.15 159.7 18.99 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.178 1.391 . . . . 0.0 111.436 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 68.3 m -67.17 -26.38 66.61 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -143.09 147.11 39.68 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 124.876 1.271 . . . . 0.0 111.889 176.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.1 -33.13 82.64 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 123.896 3.064 . . . . 0.0 114.716 173.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.9 -29.5 70.25 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.178 -0.951 . . . . 0.0 113.175 178.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.69 -24.68 64.53 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.155 0.982 . . . . 0.0 112.51 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 66.4 t -62.37 -43.24 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.233 1.013 . . . . 0.0 110.539 175.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -63.44 -39.51 94.66 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.654 0.782 . . . . 0.0 111.894 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 82.6 mt -63.79 -47.39 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.913 0.885 . . . . 0.0 110.645 176.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.24 -39.86 94.81 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.62 -43.08 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.466 0.706 . . . . 0.0 111.324 173.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -62.98 -46.76 86.16 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.022 0.828 . . . . 0.0 112.678 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 29.9 p -74.33 -20.3 60.15 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -175.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 25.5 p -57.8 -24.81 59.06 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 173.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -56.49 -20.45 20.26 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.694 1.998 . . . . 0.0 114.016 174.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -109.36 4.79 22.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.312 1.445 . . . . 0.0 113.689 -174.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -64.9 159.69 22.2 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.03 0.932 . . . . 0.0 113.136 176.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -138.43 -2.46 1.79 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.009 1.324 . . . . 0.0 114.051 174.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 76.1 p -148.64 5.95 0.71 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.172 1.389 . . . . 0.0 114.364 -172.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -158.99 173.25 16.79 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.479 1.912 . . . . 0.0 110.741 -178.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -140.83 154.98 46.45 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.171 1.788 . . . . 0.0 110.982 169.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 62.0 mt -135.93 142.68 38.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.952 1.701 . . . . 0.0 109.058 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -149.96 173.68 13.54 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.222 1.809 . . . . 0.0 110.661 172.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 37.6 p -74.65 163.36 27.81 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 120.713 -1.242 . . . . 0.0 112.248 172.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -55.86 -42.02 75.25 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.285 -0.885 . . . . 0.0 112.053 169.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.63 91.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.113 0.965 . . . . 0.0 113.27 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -62.79 -43.67 98.18 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.437 -0.789 . . . . 0.0 112.133 172.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 87.4 t80 . . . . . 0 CA--C 1.538 0.507 0 CA-C-N 118.699 0.681 . . . . 0.0 111.985 175.32 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 . . . . . 0 N--CA 1.485 1.278 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -61.49 -15.44 37.82 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.137 1.375 . . . . 0.0 114.346 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -106.42 14.91 26.67 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.263 2.225 . . . . 0.0 113.236 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 30.4 t -120.89 143.97 31.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.824 1.249 . . . . 0.0 111.008 -176.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 88.9 mt -117.0 164.52 14.59 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.122 2.169 . . . . 0.0 111.124 177.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -123.04 139.31 54.2 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.734 2.014 . . . . 0.0 107.523 167.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.31 140.95 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 124.723 1.209 . . . . 0.0 109.792 -169.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 5.0 m -132.54 133.75 44.12 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.119 1.368 . . . . 0.0 109.735 -177.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -158.98 157.86 28.51 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 124.156 0.982 . . . . 0.0 112.332 -169.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.49 146.28 43.06 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.876 3.051 . . . . 0.0 113.465 170.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -53.86 -25.2 18.63 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -62.53 -18.9 62.97 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.211 1.804 . . . . 0.0 114.381 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 17.2 m95 -69.42 157.02 37.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.568 1.147 . . . . 0.0 112.961 176.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -129.38 167.52 17.64 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.16 1.784 . . . . 0.0 111.123 173.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.2 m -51.98 -33.08 36.35 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.113 1.365 . . . . 0.0 111.901 170.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 70.3 m -64.26 -43.3 95.29 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 174.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -66.45 -31.5 72.29 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.536 -0.728 . . . . 0.0 111.231 174.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.0 mt -70.9 -42.91 69.33 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.796 0.838 . . . . 0.0 111.428 175.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -60.89 -40.98 95.13 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.99 -1.069 . . . . 0.0 111.797 169.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -60.55 -33.3 72.48 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.613 1.097 . . . . 0.0 112.714 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.8 tp -76.23 -30.18 57.82 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.858 1.263 . . . . 0.0 113.86 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -123.65 -13.11 7.56 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 116.662 2.097 . . . . 0.0 116.662 -169.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 32.3 t -58.08 -22.19 49.38 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.327 1.421 . . . . 0.0 113.635 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -54.77 -25.83 30.44 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 171.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -86.94 -18.73 30.07 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 177.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 140.22 -159.61 26.19 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.5 1.048 . . . . 0.0 113.496 -179.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -74.77 62.72 1.1 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.401 1.48 . . . . 0.0 112.281 172.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 1.2 pp -59.08 168.55 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 126.862 2.065 . . . . 0.0 113.497 178.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -130.74 150.59 51.85 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.934 1.294 . . . . 0.0 110.648 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 61.5 mt -130.97 133.19 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.217 1.407 . . . . 0.0 109.077 -174.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 45.9 m -134.94 98.21 3.95 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.387 1.475 . . . . 0.0 111.135 -177.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -57.84 148.52 25.04 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.778 1.231 . . . . 0.0 113.942 178.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 33.0 pt -135.36 -19.26 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.059 1.343 . . . . 0.0 113.872 170.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -152.88 176.93 11.3 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.776 1.231 . . . . 0.0 111.597 172.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -64.95 -12.54 50.84 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.895 1.678 . . . . 0.0 113.51 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.7 p -136.97 5.56 2.82 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.225 2.21 . . . . 0.0 113.234 -173.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 75.2 m -146.38 138.59 25.05 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.421 1.088 . . . . 0.0 113.156 -172.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.76 157.79 41.34 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.679 1.192 . . . . 0.0 112.398 176.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -89.9 154.84 19.55 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.755 0.822 . . . . 0.0 110.027 167.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.4 t -137.67 124.3 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.359 1.064 . . . . 0.0 110.15 175.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 7.5 t -93.8 132.71 37.93 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.785 1.234 . . . . 0.0 110.751 177.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 50.4 mt -111.85 161.1 16.72 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.352 1.461 . . . . 0.0 111.129 178.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 38.5 m -67.79 -25.92 65.83 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -174.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -145.55 153.98 52.0 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.187 1.395 . . . . 0.0 111.963 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.17 -20.85 32.36 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.23 2.62 . . . . 0.0 113.632 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -63.17 -35.3 79.83 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.79 -1.194 . . . . 0.0 111.818 171.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -69.35 -28.14 65.95 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.267 -0.896 . . . . 0.0 112.734 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.4 -43.68 98.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.586 0.754 . . . . 0.0 111.151 170.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 22.4 tm0? -61.39 -41.62 97.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.75 0.705 . . . . 0.0 111.588 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 95.8 mt -62.19 -47.79 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.368 0.667 . . . . 0.0 111.003 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.79 87.74 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.179 0.9 . . . . 0.0 113.383 178.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.23 -27.6 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.181 0.993 . . . . 0.0 112.117 173.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -74.53 -46.85 36.43 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 120.935 -1.103 . . . . 0.0 112.144 169.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 57.4 p -74.34 -21.23 59.79 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -174.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 84.8 p -59.49 -23.15 62.53 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -59.67 -17.75 36.57 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.198 1.399 . . . . 0.0 114.102 173.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -100.49 -0.48 37.83 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.961 1.305 . . . . 0.0 113.618 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -67.11 155.59 38.34 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.012 0.925 . . . . 0.0 112.943 176.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -138.22 -4.22 1.71 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.218 1.407 . . . . 0.0 112.7 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 70.7 p -141.75 5.54 1.78 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.902 1.681 . . . . 0.0 114.1 -172.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -156.68 169.33 24.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.273 1.829 . . . . 0.0 111.055 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 -141.1 149.33 41.44 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.147 2.179 . . . . 0.0 110.411 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 86.8 mt -137.65 142.82 35.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.633 1.573 . . . . 0.0 110.098 -177.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -144.22 164.48 30.6 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.51 1.924 . . . . 0.0 109.566 168.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 20.3 p -71.0 162.05 30.08 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 120.374 -1.454 . . . . 0.0 111.775 174.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -58.17 -36.97 73.81 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.265 -0.897 . . . . 0.0 111.834 169.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.73 92.22 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 123.643 0.777 . . . . 0.0 113.068 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.7 -39.75 95.08 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.379 -0.826 . . . . 0.0 112.029 173.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 82.5 t80 . . . . . 0 CA--C 1.541 0.63 0 C-N-CA 122.941 0.496 . . . . 0.0 112.067 172.965 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 69.2 mtt85 . . . . . 0 N--CA 1.483 1.189 0 N-CA-C 113.523 0.934 . . . . 0.0 113.523 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.79 -19.75 64.33 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 121.029 -1.044 . . . . 0.0 113.327 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 38.4 p-80 -94.66 12.71 26.76 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.546 2.338 . . . . 0.0 113.795 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 29.3 t -120.11 141.96 37.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.108 1.363 . . . . 0.0 111.656 -171.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 65.7 mt -117.13 166.68 11.94 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 127.388 2.275 . . . . 0.0 110.975 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -123.92 142.24 51.32 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 126.779 2.031 . . . . 0.0 107.883 167.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.3 t -134.74 138.6 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 124.999 1.319 . . . . 0.0 109.024 -171.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 3.7 m -125.44 135.79 52.71 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.828 1.251 . . . . 0.0 109.621 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -155.49 153.35 26.36 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 124.689 1.196 . . . . 0.0 112.059 -169.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -52.42 147.51 29.13 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.818 3.012 . . . . 0.0 113.209 169.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -57.95 -18.7 25.14 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.367 1.618 . . . . 0.0 115.367 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -81.27 -15.74 54.64 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.561 1.544 . . . . 0.0 114.0 178.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 6.6 m95 -61.43 151.38 32.72 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.224 0.92 . . . . 0.0 112.323 175.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -119.1 165.32 14.31 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.005 1.722 . . . . 0.0 111.869 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.7 m -51.77 -34.57 40.22 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.991 1.316 . . . . 0.0 111.509 168.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.8 m -65.99 -41.73 90.7 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 175.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -64.98 -31.39 72.6 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.599 -0.688 . . . . 0.0 111.183 173.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 72.8 mt -70.5 -47.41 60.65 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.653 0.781 . . . . 0.0 111.359 174.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -59.91 -32.04 70.38 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.93 -1.106 . . . . 0.0 113.064 171.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -69.86 -42.67 73.22 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.148 0.886 . . . . 0.0 112.113 172.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 55.6 tp -62.11 -33.57 74.69 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.162 1.385 . . . . 0.0 112.253 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -108.28 12.91 26.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.663 1.185 . . . . 0.0 113.536 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 23.2 t -56.3 -30.32 62.37 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.026 1.33 . . . . 0.0 113.281 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.64 -14.81 9.25 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.637 1.575 . . . . 0.0 115.081 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -111.26 -4.71 14.86 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.9 1.28 . . . . 0.0 113.684 -175.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 72.86 -31.07 0.75 Allowed Glycine 0 CA--C 1.539 1.556 0 C-N-CA 126.425 1.964 . . . . 0.0 117.196 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -148.07 129.23 14.6 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.862 1.665 . . . . 0.0 110.624 -176.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.8 pt -146.07 173.5 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.556 1.542 . . . . 0.0 112.089 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -142.0 144.5 33.7 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.298 1.439 . . . . 0.0 108.59 167.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 49.7 mt -127.42 133.7 67.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.192 0.997 . . . . 0.0 109.993 -172.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 70.6 m -136.9 103.25 5.11 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.551 1.541 . . . . 0.0 110.529 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -60.73 158.85 11.93 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.768 1.227 . . . . 0.0 114.249 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.8 -28.68 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.694 1.197 . . . . 0.0 112.252 171.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -154.1 -178.5 7.14 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.878 1.271 . . . . 0.0 111.471 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.74 -19.68 62.7 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.892 1.277 . . . . 0.0 113.065 171.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.8 p -132.31 5.64 4.11 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.99 2.116 . . . . 0.0 113.525 -169.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 18.9 m -144.08 139.88 29.17 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.667 1.187 . . . . 0.0 113.126 -175.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.13 155.2 38.42 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.241 1.416 . . . . 0.0 112.074 174.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -89.4 149.74 22.85 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.421 1.088 . . . . 0.0 109.67 167.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 58.2 t -137.3 115.52 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.281 1.032 . . . . 0.0 110.314 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 67.9 m -80.6 142.51 33.98 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.489 1.116 . . . . 0.0 110.838 170.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 68.6 mt -119.76 160.73 22.02 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.118 1.367 . . . . 0.0 110.843 172.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 65.4 m -61.57 -27.45 68.64 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.049 1.5 . . . . 0.0 115.049 -175.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -144.37 152.65 54.27 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.139 1.376 . . . . 0.0 111.573 176.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.24 -12.83 36.22 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.891 3.06 . . . . 0.0 114.032 172.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.5 -38.84 88.12 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.749 -1.219 . . . . 0.0 111.683 169.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -74.62 -25.33 59.16 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.637 0.775 . . . . 0.0 112.788 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.85 -44.15 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.437 1.495 . . . . 0.0 111.179 171.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -65.41 -36.18 83.17 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.014 0.925 . . . . 0.0 112.045 178.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 61.3 mt -64.72 -47.92 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.316 1.047 . . . . 0.0 110.49 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.38 -34.85 79.12 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.8 -41.14 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 O-C-N 121.058 -1.027 . . . . 0.0 111.11 170.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -62.66 -42.58 99.69 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -72.96 -31.38 64.52 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.739 0.816 . . . . 0.0 113.028 -178.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 10.3 t -65.04 -16.39 63.39 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 174.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -55.29 -21.88 16.4 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.383 1.473 . . . . 0.0 114.001 176.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -124.79 16.41 8.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.78 1.632 . . . . 0.0 112.994 -175.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.22 159.47 17.65 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.293 1.037 . . . . 0.0 113.113 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -135.8 -8.92 2.12 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.027 1.331 . . . . 0.0 113.098 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 71.4 p -140.54 2.43 1.82 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.497 1.519 . . . . 0.0 114.432 -172.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -157.49 176.07 13.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.438 1.895 . . . . 0.0 110.794 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -147.55 147.21 29.86 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.309 1.444 . . . . 0.0 110.827 169.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 76.0 mt -129.77 142.05 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 126.237 1.815 . . . . 0.0 109.694 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -146.55 163.14 36.71 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.789 1.636 . . . . 0.0 110.79 170.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 19.2 p -71.1 164.97 24.53 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 120.644 -1.285 . . . . 0.0 112.192 173.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -58.61 -39.4 80.35 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 121.038 -1.039 . . . . 0.0 111.983 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.8 -34.29 78.0 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.802 0.841 . . . . 0.0 113.195 177.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -71.84 -40.66 68.91 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.349 -0.845 . . . . 0.0 112.142 170.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 33.7 t80 . . . . . 0 N--CA 1.47 0.543 0 C-N-CA 124.954 1.302 . . . . 0.0 113.559 177.911 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.9 -17.75 64.87 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -173.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 38.1 p-80 -100.17 14.41 30.9 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.434 2.294 . . . . 0.0 113.352 176.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 23.4 t -120.54 133.28 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.665 1.186 . . . . 0.0 111.649 -170.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 94.1 mt -103.81 166.63 10.29 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.842 2.057 . . . . 0.0 111.669 175.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -125.32 138.75 54.07 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 127.371 2.268 . . . . 0.0 107.413 167.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.2 t -135.61 138.64 47.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 C-N-CA 124.822 1.249 . . . . 0.0 109.165 -170.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 6.9 m -126.62 131.25 51.52 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.919 1.288 . . . . 0.0 109.23 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -150.51 160.37 32.93 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.678 1.191 . . . . 0.0 112.925 -168.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -54.13 156.59 12.76 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 124.658 3.572 . . . . 0.0 115.32 177.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -58.01 -12.64 3.52 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.396 1.878 . . . . 0.0 115.913 174.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -117.63 -1.03 11.71 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.791 1.636 . . . . 0.0 113.848 -177.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 1.7 m0 -66.81 154.28 41.25 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.223 -0.923 . . . . 0.0 111.874 169.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -129.54 166.47 19.61 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.097 1.359 . . . . 0.0 113.278 -174.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.3 m -47.29 -33.38 5.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.909 1.684 . . . . 0.0 112.865 170.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 20.2 p -72.9 -41.06 65.0 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -60.49 -28.23 68.2 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.551 0.614 . . . . 0.0 110.33 168.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.2 mt -78.36 -46.2 20.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.544 0.338 . . . . 0.0 111.782 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -58.11 -39.64 79.15 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.055 -1.028 . . . . 0.0 111.989 169.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -64.37 -34.45 78.18 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.166 0.893 . . . . 0.0 112.869 174.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 44.1 tp -71.52 -28.9 64.21 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.172 0.989 . . . . 0.0 113.141 177.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -121.7 3.85 10.08 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 -172.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 75.3 p -56.77 -24.57 51.22 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.12 -15.06 8.17 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.568 1.547 . . . . 0.0 114.624 173.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -106.15 3.55 28.09 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.342 1.457 . . . . 0.0 113.861 -177.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 82.55 -45.44 3.38 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.879 1.704 . . . . 0.0 115.572 169.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -150.85 143.91 24.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.935 1.294 . . . . 0.0 111.127 177.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 24.1 pt -144.78 171.42 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 125.209 1.404 . . . . 0.0 112.076 -175.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -138.33 105.68 5.52 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.244 1.018 . . . . 0.0 109.521 167.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.9 mt -74.53 135.72 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.094 0.958 . . . . 0.0 108.477 172.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.7 m -138.99 96.71 3.16 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.503 1.921 . . . . 0.0 109.523 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -58.18 155.94 10.51 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -173.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 8.5 mt -131.72 -41.1 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.177 1.391 . . . . 0.0 110.054 176.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -156.49 179.89 8.83 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.443 1.497 . . . . 0.0 111.441 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -56.23 -20.26 17.52 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.619 1.968 . . . . 0.0 114.087 173.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.6 p -131.42 4.02 4.29 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.273 1.829 . . . . 0.0 113.778 -173.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 69.5 m -144.4 139.42 28.4 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.12 0.968 . . . . 0.0 112.894 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -149.88 152.02 34.39 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.669 1.188 . . . . 0.0 112.24 175.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -89.42 151.73 21.87 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.829 0.852 . . . . 0.0 108.788 167.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 49.3 t -140.51 111.14 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.867 0.867 . . . . 0.0 110.591 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 72.4 m -73.84 143.71 45.8 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.796 0.838 . . . . 0.0 110.629 169.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 67.3 mt -118.81 164.63 15.12 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.701 1.6 . . . . 0.0 110.516 171.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 63.3 m -62.71 -28.86 70.24 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -144.35 152.75 54.6 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 124.701 1.2 . . . . 0.0 112.346 -177.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.94 -16.67 32.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.457 2.771 . . . . 0.0 113.807 173.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.41 -38.48 90.05 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.946 -1.096 . . . . 0.0 111.813 170.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -67.13 -31.04 71.22 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.259 1.024 . . . . 0.0 112.338 179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 43.4 t -58.28 -40.04 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.986 0.914 . . . . 0.0 111.283 171.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -65.77 -38.37 88.87 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.62 -0.675 . . . . 0.0 111.683 178.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 78.8 mt -65.3 -44.51 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.236 1.014 . . . . 0.0 110.669 175.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.21 -41.14 99.1 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.324 -0.86 . . . . 0.0 112.868 176.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 57.8 t -67.52 -31.56 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.147 0.979 . . . . 0.0 112.303 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -69.4 -49.73 52.61 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.028 -1.045 . . . . 0.0 111.854 171.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 23.7 p -71.37 -24.46 62.09 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -174.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 60.1 p -67.1 -14.29 62.76 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 176.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -59.88 -16.14 26.88 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.81 1.244 . . . . 0.0 113.734 169.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -119.17 10.95 12.21 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.628 1.571 . . . . 0.0 112.777 -172.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.68 164.24 10.13 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.97 1.308 . . . . 0.0 112.657 170.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -136.53 -27.95 1.03 Allowed 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -177.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 42.9 m -133.4 5.65 3.77 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.673 1.189 . . . . 0.0 113.856 -175.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -150.41 176.16 11.18 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.581 1.952 . . . . 0.0 110.468 -176.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -144.27 150.77 38.43 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.547 1.139 . . . . 0.0 111.397 173.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 34.2 mt -133.87 140.1 47.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.345 1.858 . . . . 0.0 108.541 177.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -149.65 172.43 15.06 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.101 1.76 . . . . 0.0 110.319 174.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 32.3 p -72.61 163.14 28.54 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.715 -1.241 . . . . 0.0 111.959 171.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -54.54 -41.66 70.02 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.267 -0.896 . . . . 0.0 111.848 169.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.76 -35.76 80.85 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.68 -33.2 73.56 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.024 -1.048 . . . . 0.0 112.926 175.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 81.9 t80 . . . . . 0 CA--C 1.541 0.601 0 O-C-N 121.721 -0.612 . . . . 0.0 111.813 170.46 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 . . . . . 0 N--CA 1.482 1.171 0 N-CA-C 113.844 1.053 . . . . 0.0 113.844 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -63.04 -14.29 46.28 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 177.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -93.62 7.7 43.7 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.701 1.6 . . . . 0.0 114.0 173.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 19.0 t -117.64 139.07 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.711 1.204 . . . . 0.0 111.772 -170.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.7 mt -113.15 166.3 11.57 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.711 2.004 . . . . 0.0 111.537 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -127.72 140.9 51.78 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.526 2.331 . . . . 0.0 107.88 168.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.2 t -136.18 141.04 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.959 1.304 . . . . 0.0 109.498 -169.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 6.7 m -134.14 136.14 43.62 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.724 1.209 . . . . 0.0 109.848 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.7 p90 -158.86 159.04 29.59 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.277 1.031 . . . . 0.0 112.679 -169.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -52.6 147.53 30.27 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 124.225 3.284 . . . . 0.0 114.069 171.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -60.72 -12.74 11.41 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 115.854 1.798 . . . . 0.0 115.854 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -75.11 -17.59 60.4 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.879 1.272 . . . . 0.0 113.953 176.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -65.39 154.77 37.43 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -178.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -119.79 164.81 15.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 127.044 2.138 . . . . 0.0 111.697 173.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.6 m -55.81 -31.64 62.85 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.163 0.985 . . . . 0.0 110.908 168.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.0 m -64.53 -40.85 96.37 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 172.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -66.49 -30.24 70.53 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.613 -0.679 . . . . 0.0 111.202 173.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 49.7 mt -70.5 -44.81 66.86 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.354 0.662 . . . . 0.0 111.542 173.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -57.73 -39.61 77.71 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 120.993 -1.067 . . . . 0.0 111.962 169.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 64.3 tp60 -67.82 -33.18 74.28 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.075 0.852 . . . . 0.0 113.257 175.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.5 tp -69.87 -32.02 70.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.467 1.107 . . . . 0.0 112.725 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -115.96 6.02 14.08 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -172.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 79.2 p -58.54 -23.85 59.24 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.941 1.297 . . . . 0.0 114.349 175.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.23 -13.09 4.33 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.622 1.569 . . . . 0.0 114.38 172.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -114.21 5.23 15.8 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.847 1.659 . . . . 0.0 113.304 -176.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 72.02 -122.57 9.08 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.473 1.035 . . . . 0.0 112.576 177.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -60.64 128.48 36.81 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.412 1.085 . . . . 0.0 111.862 173.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 28.4 pt -142.67 167.52 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.807 1.643 . . . . 0.0 110.894 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -137.98 99.51 3.91 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.155 1.382 . . . . 0.0 110.537 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 56.3 mt -79.74 143.2 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.612 1.565 . . . . 0.0 109.644 177.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 7.9 t -141.14 111.61 6.89 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.937 1.295 . . . . 0.0 111.399 175.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -62.39 154.2 28.91 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 7.3 mt -132.68 -44.34 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.982 1.313 . . . . 0.0 110.115 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -153.03 177.38 10.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.326 1.85 . . . . 0.0 109.416 170.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.26 1.13 2.3 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -174.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 69.1 p -138.09 5.29 2.54 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 127.259 2.224 . . . . 0.0 113.199 -175.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 88.2 p -154.2 149.36 26.94 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.39 152.48 33.16 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.109 1.364 . . . . 0.0 111.919 -176.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -89.42 153.96 20.43 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 166.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 40.6 t -139.54 109.73 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.548 0.739 . . . . 0.0 110.081 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 24.7 m -77.33 132.76 38.75 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.358 1.063 . . . . 0.0 109.53 168.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 77.0 mt -112.35 158.59 19.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.997 1.319 . . . . 0.0 110.516 176.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 58.5 m -68.12 -21.5 64.94 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -174.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -143.28 150.75 52.99 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 124.896 1.278 . . . . 0.0 111.751 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.74 -16.54 37.7 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.463 2.775 . . . . 0.0 113.747 175.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -65.58 -36.51 83.98 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.038 -1.039 . . . . 0.0 112.161 171.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -69.35 -31.88 70.6 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.456 1.102 . . . . 0.0 112.073 -178.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.01 -42.01 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.806 1.242 . . . . 0.0 111.462 171.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 52.8 mm-40 -64.52 -39.17 93.29 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.886 -0.509 . . . . 0.0 111.697 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.98 -48.29 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 124.218 1.007 . . . . 0.0 110.507 177.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.52 -36.97 85.54 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.4 t -64.55 -40.14 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 121.188 -0.945 . . . . 0.0 111.194 171.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -63.48 -47.66 80.86 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.774 0.715 . . . . 0.0 112.58 175.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.7 p -69.54 -29.51 67.12 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -175.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 11.1 t -62.61 -18.81 62.94 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -60.29 -16.55 35.37 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -123.53 8.17 8.95 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.765 1.626 . . . . 0.0 112.724 -173.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -66.84 155.29 38.7 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.107 1.363 . . . . 0.0 112.74 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -133.61 -9.56 2.81 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.681 1.193 . . . . 0.0 113.994 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 40.4 m -136.87 6.51 2.91 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.205 1.402 . . . . 0.0 113.588 -175.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -160.97 171.84 17.97 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.539 1.936 . . . . 0.0 110.576 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -141.61 151.21 42.92 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.425 1.89 . . . . 0.0 110.451 169.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 62.0 mt -132.7 142.8 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 126.189 1.796 . . . . 0.0 109.6 -179.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -144.6 164.47 30.84 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.02 1.728 . . . . 0.0 110.02 169.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 32.6 p -72.0 164.78 25.51 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 120.604 -1.31 . . . . 0.0 112.065 172.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -59.27 -39.37 82.66 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.943 -1.098 . . . . 0.0 112.095 169.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -63.6 -36.91 85.35 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.64 0.776 . . . . 0.0 112.845 176.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -66.23 -47.14 74.8 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.424 -0.798 . . . . 0.0 111.854 169.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 42.4 t80 . . . . . 0 N--CA 1.469 0.482 0 CA-C-N 118.687 0.676 . . . . 0.0 112.378 179.851 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.1 mmt-85 . . . . . 0 N--CA 1.483 1.188 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -62.36 -23.13 66.63 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.074 0.95 . . . . 0.0 113.492 179.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -99.99 12.84 35.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.834 2.054 . . . . 0.0 113.227 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 38.3 t -118.96 137.28 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.746 1.218 . . . . 0.0 111.818 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 61.3 mt -117.33 166.26 12.51 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 127.121 2.168 . . . . 0.0 110.762 175.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -124.46 142.33 51.4 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 127.362 2.265 . . . . 0.0 107.935 168.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 9.2 t -134.03 138.29 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.638 1.175 . . . . 0.0 109.235 -173.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.3 m -123.09 135.16 54.27 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.858 1.263 . . . . 0.0 109.898 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -158.7 157.3 28.4 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.485 1.114 . . . . 0.0 112.512 -170.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.18 146.03 73.31 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.783 2.989 . . . . 0.0 112.485 168.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -58.44 -18.86 31.75 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 -177.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -64.34 -19.25 65.33 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.724 1.209 . . . . 0.0 113.913 175.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 16.3 m95 -67.39 162.46 22.95 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.471 1.108 . . . . 0.0 113.151 175.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -143.1 169.92 16.69 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 127.255 2.222 . . . . 0.0 110.947 178.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.2 m -51.45 -30.79 20.84 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.292 1.837 . . . . 0.0 112.121 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 14.4 p -74.76 -43.04 56.94 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 177.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -61.15 -26.09 67.46 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.91 -0.494 . . . . 0.0 110.702 169.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 76.1 mt -78.78 -44.51 23.07 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 122.772 0.429 . . . . 0.0 111.477 176.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -57.14 -37.22 71.71 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.029 -1.045 . . . . 0.0 112.143 169.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -68.45 -37.75 80.5 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.943 0.897 . . . . 0.0 113.058 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 59.6 tp -68.36 -28.49 67.17 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.328 1.051 . . . . 0.0 112.975 176.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -117.23 8.74 13.27 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -172.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 81.8 p -58.14 -27.26 63.61 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.68 -18.23 40.5 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.243 1.417 . . . . 0.0 114.63 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -94.11 0.58 55.94 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.878 1.271 . . . . 0.0 114.267 -177.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.97 -45.85 3.39 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.837 1.684 . . . . 0.0 115.182 169.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -150.55 133.83 16.27 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.927 1.291 . . . . 0.0 110.78 175.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 15.4 pt -143.48 171.93 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.468 1.507 . . . . 0.0 111.367 -174.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -138.77 152.14 47.68 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.723 1.609 . . . . 0.0 110.302 169.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 76.2 mt -134.08 139.64 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.082 1.353 . . . . 0.0 109.707 -169.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 7.0 t -144.42 107.24 4.46 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.047 0.939 . . . . 0.0 112.588 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -63.23 148.89 46.87 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 37.0 pt -134.8 -20.93 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.939 1.296 . . . . 0.0 113.714 171.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -153.19 178.77 9.38 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.842 1.257 . . . . 0.0 111.229 173.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -66.84 -15.46 63.63 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.59 1.156 . . . . 0.0 112.698 174.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 39.5 p -132.57 8.47 4.22 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.656 1.982 . . . . 0.0 112.976 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 3.7 m -149.34 142.67 25.18 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.564 1.146 . . . . 0.0 113.543 -177.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.29 160.47 43.79 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.514 1.526 . . . . 0.0 111.377 174.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -89.34 154.57 19.98 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.808 0.843 . . . . 0.0 110.116 168.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 60.9 t -133.8 112.23 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 124.543 1.137 . . . . 0.0 109.164 171.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 37.7 m -85.7 135.11 33.89 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.655 1.582 . . . . 0.0 109.945 172.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 79.4 mt -118.64 164.01 15.96 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.973 1.309 . . . . 0.0 111.458 -177.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 58.1 m -69.44 -22.36 63.67 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -177.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -146.75 151.32 42.11 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.185 1.394 . . . . 0.0 112.351 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.19 -19.53 33.95 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.481 2.787 . . . . 0.0 113.303 173.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -64.09 -36.27 83.46 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.601 -1.312 . . . . 0.0 111.897 169.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -68.98 -31.7 70.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.061 0.944 . . . . 0.0 112.244 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 86.8 t -57.7 -46.38 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 125.09 1.356 . . . . 0.0 110.753 172.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -63.46 -41.67 98.61 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.263 0.625 . . . . 0.0 112.223 177.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 95.6 mt -62.51 -44.04 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.925 0.89 . . . . 0.0 111.213 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -65.23 -39.45 92.74 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.074 -1.016 . . . . 0.0 113.082 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 80.6 t -65.54 -40.94 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 121.189 -0.944 . . . . 0.0 111.49 174.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -62.01 -48.11 81.78 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.353 1.061 . . . . 0.0 112.533 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 25.4 p -73.16 -27.96 61.96 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.025 0.93 . . . . 0.0 113.151 -175.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.1 t -64.65 -14.91 60.22 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 171.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -60.75 -14.38 20.9 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.686 1.194 . . . . 0.0 113.431 169.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -114.12 8.26 16.92 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.493 1.917 . . . . 0.0 112.871 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.66 160.96 21.57 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.857 1.263 . . . . 0.0 113.122 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.66 -7.82 1.1 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 32.6 m -140.89 8.73 2.12 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.135 1.374 . . . . 0.0 113.631 -178.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 55.6 p90 -160.01 173.89 15.18 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.243 1.817 . . . . 0.0 110.841 -176.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -147.73 143.47 27.6 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.036 1.334 . . . . 0.0 110.826 169.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 71.8 mt -120.35 137.18 54.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 126.222 1.809 . . . . 0.0 109.322 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -147.21 169.06 20.15 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.106 1.363 . . . . 0.0 111.293 174.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 43.9 p -71.73 162.66 29.1 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.945 -1.097 . . . . 0.0 112.652 176.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -56.28 -37.08 69.36 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.605 0.762 . . . . 0.0 112.322 169.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -68.02 -40.0 83.02 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.046 0.938 . . . . 0.0 113.152 176.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -67.77 -32.83 73.68 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.045 -1.034 . . . . 0.0 112.505 174.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 21.2 t80 . . . . . 0 CA--C 1.541 0.597 0 C-N-CA 124.064 0.946 . . . . 0.0 111.796 170.327 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 78.7 mtm-85 . . . . . 0 N--CA 1.481 1.076 0 N-CA-C 113.912 1.078 . . . . 0.0 113.912 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -63.95 -16.36 61.35 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.466 1.107 . . . . 0.0 113.521 174.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -89.12 11.0 19.79 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.912 2.085 . . . . 0.0 113.83 172.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 44.1 t -121.96 137.23 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 125.169 1.388 . . . . 0.0 110.734 -176.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.7 mt -98.73 162.67 12.99 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 125.871 1.668 . . . . 0.0 111.95 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -118.34 138.45 52.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 127.658 2.383 . . . . 0.0 106.287 166.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.8 t -136.33 139.98 44.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 124.233 1.013 . . . . 0.0 109.417 -169.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.7 m -131.24 134.04 46.05 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.18 1.392 . . . . 0.0 109.699 -178.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -157.5 158.43 30.65 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 124.273 1.029 . . . . 0.0 112.504 -169.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -55.81 144.76 75.67 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.318 2.679 . . . . 0.0 111.923 168.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -55.39 -24.4 29.71 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 115.316 1.598 . . . . 0.0 115.316 -176.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -63.15 -21.21 66.05 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.149 1.379 . . . . 0.0 113.782 178.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 13.4 m95 -63.69 152.74 38.27 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.081 0.953 . . . . 0.0 112.547 174.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 43.2 mttm -133.56 171.82 13.57 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.211 1.804 . . . . 0.0 111.653 176.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.1 m -50.62 -35.01 28.36 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.341 1.456 . . . . 0.0 112.338 172.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.5 m -65.07 -42.4 94.2 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 175.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.12 -31.45 72.32 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.623 -0.673 . . . . 0.0 111.246 174.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 78.1 mt -70.91 -44.51 66.07 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.884 0.874 . . . . 0.0 111.507 175.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -57.28 -41.97 80.77 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.24 -0.912 . . . . 0.0 111.938 169.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.25 -39.07 92.16 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 118.808 0.731 . . . . 0.0 112.947 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.0 tp -65.98 -35.05 79.53 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.618 1.167 . . . . 0.0 112.398 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -111.71 5.83 19.45 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -173.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 24.5 t -53.63 -30.64 43.77 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.399 1.479 . . . . 0.0 113.515 173.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.6 -12.15 3.79 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 125.778 1.631 . . . . 0.0 115.129 175.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -113.53 3.08 15.58 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.662 1.585 . . . . 0.0 113.534 -177.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 93.74 -151.62 20.39 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.476 1.036 . . . . 0.0 112.686 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -62.28 150.75 38.34 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.584 0.754 . . . . 0.0 112.286 170.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 27.4 pt -144.76 179.21 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 126.061 1.744 . . . . 0.0 111.245 -174.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -137.95 143.53 40.78 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.81 1.244 . . . . 0.0 109.338 168.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.9 mt -127.5 130.99 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.723 1.209 . . . . 0.0 109.456 -171.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 63.7 m -137.58 98.94 3.81 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.447 1.499 . . . . 0.0 110.993 -174.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 94.9 m95 -57.94 152.44 16.23 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.508 1.123 . . . . 0.0 113.923 179.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 36.5 pt -134.05 -22.31 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.778 1.231 . . . . 0.0 113.401 169.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -154.1 178.2 10.23 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.395 1.078 . . . . 0.0 111.982 174.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -66.23 -14.57 62.14 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.756 1.622 . . . . 0.0 113.189 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.2 p -132.76 8.09 4.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.261 1.824 . . . . 0.0 113.434 -175.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 58.0 p -156.75 151.98 26.41 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.84 162.08 41.52 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.656 1.582 . . . . 0.0 112.051 -177.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -94.61 150.58 20.09 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.13 0.972 . . . . 0.0 110.124 167.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 47.5 t -138.99 113.79 8.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.318 1.047 . . . . 0.0 110.848 177.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 50.9 m -76.48 136.22 39.37 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.963 1.305 . . . . 0.0 111.466 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 74.0 mt -118.57 163.92 16.07 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.582 1.553 . . . . 0.0 110.236 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 50.9 m -69.6 -23.45 63.52 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -174.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -148.19 146.39 23.13 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.752 1.221 . . . . 0.0 112.959 -176.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.69 -29.99 73.49 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.786 2.99 . . . . 0.0 114.177 168.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.0 mp0 -60.89 -37.21 81.4 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.944 -1.097 . . . . 0.0 112.073 174.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -70.19 -36.38 74.58 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.379 -0.826 . . . . 0.0 111.62 175.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 15.1 t -58.86 -47.84 88.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.708 0.803 . . . . 0.0 111.223 170.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.72 -41.33 90.6 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.519 0.599 . . . . 0.0 112.255 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 82.8 mt -62.56 -50.55 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.479 0.712 . . . . 0.0 110.983 174.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.92 -36.28 82.85 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 62.6 t -65.35 -41.0 90.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.386 -0.821 . . . . 0.0 111.048 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -64.1 -45.63 87.77 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.14 0.882 . . . . 0.0 112.814 175.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 49.1 p -72.09 -22.07 61.4 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 25.1 p -60.14 -17.33 39.67 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 175.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -52.82 -22.97 6.02 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.506 1.922 . . . . 0.0 113.717 169.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -123.9 20.51 9.2 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.993 1.717 . . . . 0.0 112.715 -175.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.79 -37.75 88.55 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 52.91 -20.68 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 130.014 3.326 . . . . 0.0 118.819 -176.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 51.1 m -136.2 3.63 2.88 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.4 1.48 . . . . 0.0 114.027 -173.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -156.42 177.72 11.14 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.103 2.161 . . . . 0.0 109.85 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -143.76 150.22 38.27 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.929 1.292 . . . . 0.0 111.022 175.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 92.0 mt -129.52 145.37 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.554 1.542 . . . . 0.0 110.079 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -141.16 170.19 16.19 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.799 2.44 . . . . 0.0 108.731 172.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 31.9 p -79.29 163.92 24.53 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.495 -1.378 . . . . 0.0 110.069 167.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -55.95 -43.32 77.35 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.378 -0.826 . . . . 0.0 111.678 169.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -67.85 -38.88 83.7 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -62.64 -38.97 92.36 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.534 1.534 . . . . 0.0 111.769 176.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 93.2 t80 . . . . . 0 CA--C 1.54 0.572 0 C-N-CA 123.318 0.647 . . . . 0.0 112.436 170.708 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? . . . . . 0 N--CA 1.485 1.297 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -65.73 -21.91 66.56 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.238 1.015 . . . . 0.0 113.684 -176.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 -95.0 12.99 26.49 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.425 1.89 . . . . 0.0 113.672 176.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 38.2 t -116.98 134.12 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.422 1.089 . . . . 0.0 111.362 -170.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 89.8 mt -102.2 164.96 11.4 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.593 1.957 . . . . 0.0 111.24 174.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -124.05 138.04 54.5 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 127.196 2.198 . . . . 0.0 107.34 167.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -135.42 138.49 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.695 1.198 . . . . 0.0 109.387 -169.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 10.1 m -127.05 136.03 51.63 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.221 1.408 . . . . 0.0 109.501 -177.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -159.91 158.93 27.3 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 124.128 0.971 . . . . 0.0 113.131 -168.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -58.02 146.42 87.48 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.464 2.776 . . . . 0.0 111.346 167.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.62 -21.29 38.47 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -175.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -62.44 -22.47 66.22 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.697 1.599 . . . . 0.0 113.985 174.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.0 m95 -62.96 148.91 46.14 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 122.07 0.938 . . . . 0.0 113.068 173.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 25.4 mtmm -132.73 166.19 22.78 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.457 1.903 . . . . 0.0 111.377 -172.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.5 m -52.75 -33.68 49.34 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.406 1.083 . . . . 0.0 111.837 169.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 75.5 m -66.61 -45.88 77.69 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.492 1.117 . . . . 0.0 113.912 173.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.54 -34.49 77.91 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.508 -0.745 . . . . 0.0 111.079 175.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 77.3 mt -67.42 -43.86 80.18 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.251 1.02 . . . . 0.0 111.278 173.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.48 -42.09 86.72 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.112 -0.993 . . . . 0.0 112.507 170.67 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -64.97 -30.53 71.53 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.168 0.894 . . . . 0.0 113.191 175.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 51.6 tp -74.51 -29.88 61.58 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.554 1.142 . . . . 0.0 113.262 175.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -122.01 -4.34 9.05 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -169.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 83.0 p -57.96 -23.27 53.0 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 120.064 1.302 . . . . 0.0 114.256 174.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.13 -14.63 7.25 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.64 1.576 . . . . 0.0 114.345 171.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -109.86 3.07 20.29 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.888 1.675 . . . . 0.0 113.309 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 101.87 -158.53 18.43 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.822 1.201 . . . . 0.0 112.801 -176.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -63.53 152.89 37.33 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.428 0.691 . . . . 0.0 112.199 170.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 31.4 pt -143.93 174.64 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.485 1.514 . . . . 0.0 111.659 -173.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -137.24 151.57 48.88 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.433 1.493 . . . . 0.0 110.177 168.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 71.5 mt -136.17 131.19 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 124.479 1.112 . . . . 0.0 110.303 -169.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 51.7 m -137.54 103.73 5.13 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.131 1.772 . . . . 0.0 109.763 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 61.4 m95 -75.32 160.44 30.32 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.54 -0.725 . . . . 0.0 112.852 -174.085 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 29.9 pt -135.48 -18.94 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.807 1.243 . . . . 0.0 113.677 175.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -151.65 179.05 8.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.651 1.18 . . . . 0.0 111.737 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -69.23 -10.8 59.48 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.563 1.545 . . . . 0.0 113.05 170.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 39.9 p -135.43 3.34 3.06 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.839 1.656 . . . . 0.0 113.929 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 89.1 p -155.15 155.37 33.83 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 170.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -154.15 160.37 41.86 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.195 1.398 . . . . 0.0 112.473 -176.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -91.76 148.88 21.92 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.907 0.883 . . . . 0.0 110.675 168.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 48.8 t -136.42 111.78 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.808 1.243 . . . . 0.0 110.28 178.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 69.8 m -79.07 115.57 18.83 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.666 1.586 . . . . 0.0 110.575 173.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 65.7 mt -82.73 163.61 21.19 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.384 0.673 . . . . 0.0 111.02 169.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 87.5 p -67.47 -21.57 65.52 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 176.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -147.76 145.03 20.03 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.445 1.498 . . . . 0.0 111.691 -177.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -71.54 -18.07 29.59 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.411 2.741 . . . . 0.0 113.372 172.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -62.45 -26.9 68.76 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.043 -1.036 . . . . 0.0 112.789 172.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -92.97 -17.62 23.71 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.546 1.138 . . . . 0.0 113.012 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 28.9 t -57.39 -45.28 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.748 1.219 . . . . 0.0 110.973 171.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -61.73 -34.59 76.09 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.47 0.708 . . . . 0.0 112.753 177.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 47.6 mt -68.23 -46.09 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.613 0.765 . . . . 0.0 110.367 178.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.73 -40.67 97.91 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.432 -0.792 . . . . 0.0 112.725 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 73.1 t -67.98 -32.31 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.014 0.926 . . . . 0.0 112.441 175.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -68.96 -47.91 64.47 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.099 -1.001 . . . . 0.0 112.07 171.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 24.3 p -76.23 -22.81 54.77 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -172.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 55.8 p -61.17 -18.23 57.07 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 175.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -55.59 -19.84 11.59 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.015 1.726 . . . . 0.0 113.601 169.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -122.99 18.76 10.09 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.14 1.776 . . . . 0.0 112.671 -175.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -60.62 162.94 5.9 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.522 1.529 . . . . 0.0 113.913 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -129.74 -15.21 3.96 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -171.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 14.9 t -154.95 10.93 0.35 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.034 1.334 . . . . 0.0 112.75 -176.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -158.07 175.39 13.86 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.124 1.37 . . . . 0.0 111.913 -169.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -145.6 152.44 39.68 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.961 1.704 . . . . 0.0 110.402 169.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 42.2 mt -136.17 142.71 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.44 1.496 . . . . 0.0 110.317 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -146.9 169.13 19.79 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.852 2.061 . . . . 0.0 109.808 169.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 16.8 p -71.8 164.63 25.65 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 120.038 -1.664 . . . . 0.0 112.404 171.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -56.28 -42.25 77.18 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.105 -0.997 . . . . 0.0 111.856 169.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.39 87.19 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.687 0.795 . . . . 0.0 112.94 177.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -64.37 -41.37 96.73 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.352 -0.843 . . . . 0.0 111.965 172.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 66.1 t80 . . . . . 0 CA--C 1.538 0.509 0 CA-C-N 118.973 0.806 . . . . 0.0 111.677 172.72 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 . . . . . 0 N--CA 1.484 1.26 0 N-CA-C 114.168 1.173 . . . . 0.0 114.168 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.33 -12.72 44.86 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.082 1.353 . . . . 0.0 114.298 -178.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -115.28 13.46 16.67 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.187 2.195 . . . . 0.0 113.062 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 54.7 t -114.24 125.02 71.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.606 1.162 . . . . 0.0 111.153 -170.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.6 mt -92.23 164.11 13.67 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.374 1.47 . . . . 0.0 111.79 170.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -122.41 134.76 54.6 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 127.19 2.196 . . . . 0.0 106.663 166.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.8 t -130.18 136.36 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 125.111 1.364 . . . . 0.0 109.022 -169.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 11.6 m -129.66 135.57 48.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.081 1.353 . . . . 0.0 109.422 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -158.9 158.38 29.04 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 123.904 0.881 . . . . 0.0 112.788 -169.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -56.46 143.23 88.09 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 122.976 2.451 . . . . 0.0 110.82 166.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -58.13 -19.45 32.64 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -176.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -61.52 -21.37 64.17 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.171 1.388 . . . . 0.0 113.946 174.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -64.02 151.1 43.83 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.801 0.84 . . . . 0.0 112.541 172.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -136.64 167.66 20.99 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.044 1.738 . . . . 0.0 111.568 179.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.9 m -51.62 -36.38 45.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.242 1.417 . . . . 0.0 112.817 177.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 72.5 m -67.63 -39.12 84.67 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 176.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -67.38 -31.7 72.11 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.319 -0.863 . . . . 0.0 110.965 173.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.3 mt -71.18 -46.24 61.77 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.068 0.947 . . . . 0.0 111.223 176.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -57.16 -37.87 72.72 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.029 -1.044 . . . . 0.0 112.846 171.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -69.72 -37.41 76.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.092 0.957 . . . . 0.0 113.31 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 66.2 tp -62.83 -34.25 76.93 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.559 1.143 . . . . 0.0 112.233 176.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -105.23 5.95 32.53 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 -176.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 21.4 t -54.93 -29.27 55.93 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.908 1.283 . . . . 0.0 113.406 176.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.82 -13.02 5.09 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.81 1.644 . . . . 0.0 115.21 173.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -117.61 5.74 12.41 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.702 1.601 . . . . 0.0 113.168 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 78.19 -148.47 32.9 Favored Glycine 0 CA--C 1.535 1.314 0 O-C-N 121.291 -0.88 . . . . 0.0 112.992 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -59.67 142.5 52.88 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.218 1.007 . . . . 0.0 112.678 177.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 10.2 pt -143.59 177.86 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 126.29 1.836 . . . . 0.0 111.287 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -132.57 144.85 50.67 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.634 1.174 . . . . 0.0 110.048 169.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.1 mt -126.41 131.85 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.157 1.383 . . . . 0.0 109.044 -172.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 56.8 m -134.92 96.43 3.52 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.799 1.64 . . . . 0.0 110.755 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -57.46 150.03 19.59 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.256 1.022 . . . . 0.0 113.209 177.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 38.1 pt -133.16 -19.13 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.658 1.183 . . . . 0.0 113.237 170.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -152.06 170.87 18.87 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.247 1.419 . . . . 0.0 111.785 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -61.46 -17.52 54.83 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.16 1.784 . . . . 0.0 113.097 170.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 72.8 p -130.04 4.1 4.86 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.979 1.712 . . . . 0.0 114.69 -176.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 98.7 p -154.74 157.09 37.5 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 174.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.69 163.18 40.16 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.771 1.629 . . . . 0.0 112.207 -177.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -98.26 151.36 20.56 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.425 1.09 . . . . 0.0 110.18 167.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 89.6 t -139.32 117.85 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.05 0.94 . . . . 0.0 111.088 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 73.2 m -83.16 116.29 22.29 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.55 1.54 . . . . 0.0 110.581 173.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 64.0 mt -85.65 160.4 19.59 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.169 0.987 . . . . 0.0 111.649 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 93.7 p -73.01 -19.83 61.12 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -142.27 149.14 50.59 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.48 1.512 . . . . 0.0 110.925 174.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -70.25 -23.71 28.26 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.943 2.428 . . . . 0.0 113.645 179.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -63.68 -30.05 71.2 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.944 -1.097 . . . . 0.0 112.679 175.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -69.56 -24.44 63.7 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.09 1.356 . . . . 0.0 112.685 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.69 -47.46 91.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.398 1.079 . . . . 0.0 110.987 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -62.13 -37.94 87.06 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.103 0.561 . . . . 0.0 112.068 177.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 68.0 mt -62.04 -54.72 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.732 0.813 . . . . 0.0 110.143 176.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.15 86.13 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -178.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 65.0 t -63.8 -45.09 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.239 -0.913 . . . . 0.0 110.922 172.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.73 -45.93 91.81 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.72 0.808 . . . . 0.0 112.93 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.9 p -70.17 -22.78 62.93 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.269 1.028 . . . . 0.0 113.513 -177.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 47.5 m -90.0 -6.56 55.47 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -177.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt -56.41 -16.4 5.7 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 172.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -126.49 9.93 7.22 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.967 1.707 . . . . 0.0 113.035 -173.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.4 156.16 33.14 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.801 1.241 . . . . 0.0 112.795 177.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -131.28 -6.74 3.81 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 43.0 m -132.3 1.78 3.83 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.204 1.402 . . . . 0.0 113.511 -177.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 45.8 p90 -163.02 174.39 12.35 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.812 2.445 . . . . 0.0 109.621 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -147.6 148.21 30.88 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.567 1.547 . . . . 0.0 110.868 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 74.7 mt -131.7 144.98 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 125.684 1.593 . . . . 0.0 110.505 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -147.17 170.56 16.97 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.933 2.093 . . . . 0.0 109.87 171.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 20.9 p -73.5 162.92 28.72 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.576 -1.328 . . . . 0.0 111.716 172.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -55.1 -41.15 71.24 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.409 -0.807 . . . . 0.0 112.156 169.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -70.02 -38.02 75.78 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 179.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -64.38 -41.27 96.78 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.413 -0.805 . . . . 0.0 111.698 173.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 25.5 t80 . . . . . 0 CA--C 1.541 0.6 0 C-N-CA 123.423 0.689 . . . . 0.0 111.791 172.089 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 . . . . . 0 N--CA 1.483 1.22 0 CA-C-O 121.471 0.653 . . . . 0.0 112.699 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -59.74 -22.23 61.79 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.69 1.196 . . . . 0.0 113.782 176.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 -82.53 7.54 14.2 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.545 1.938 . . . . 0.0 114.285 173.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 19.6 t -123.39 140.79 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 125.064 1.345 . . . . 0.0 111.509 -170.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 82.2 mt -115.43 164.69 13.92 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 127.573 2.349 . . . . 0.0 110.499 176.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -122.88 140.86 52.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.556 1.942 . . . . 0.0 108.246 168.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.5 t -133.47 138.16 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 124.772 1.229 . . . . 0.0 109.202 -170.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 12.1 m -128.19 137.91 52.25 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.142 1.377 . . . . 0.0 109.511 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -158.8 158.66 29.38 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.184 0.994 . . . . 0.0 112.38 -169.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -54.98 142.51 76.11 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.258 2.639 . . . . 0.0 111.89 168.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -57.0 -21.22 28.99 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.61 -20.66 66.4 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.013 1.325 . . . . 0.0 114.006 174.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -64.81 151.79 44.47 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.817 0.847 . . . . 0.0 112.194 173.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -133.26 171.9 13.41 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.902 1.681 . . . . 0.0 112.054 177.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.7 m -50.7 -35.03 29.13 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.475 1.51 . . . . 0.0 112.399 174.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.6 m -63.9 -44.76 92.04 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 174.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -65.48 -31.14 72.05 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.353 0.661 . . . . 0.0 111.391 175.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 83.6 mt -72.2 -45.87 58.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.804 0.842 . . . . 0.0 111.587 176.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.1 -36.17 74.69 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.101 -0.999 . . . . 0.0 112.616 170.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -68.28 -39.37 82.17 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.886 0.766 . . . . 0.0 112.842 174.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 48.4 tp -65.99 -40.82 91.51 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.713 1.205 . . . . 0.0 112.028 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -99.62 9.71 42.66 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.022 0.929 . . . . 0.0 113.471 -177.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 21.7 t -54.84 -31.48 59.52 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.459 1.504 . . . . 0.0 113.599 177.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.48 -14.0 6.87 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.585 1.554 . . . . 0.0 115.081 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -106.42 0.77 25.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.261 1.425 . . . . 0.0 113.767 -177.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.86 -47.19 3.26 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 126.097 1.808 . . . . 0.0 115.81 169.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -144.07 137.64 27.72 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.421 1.489 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 22.1 pt -146.5 174.92 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.386 1.474 . . . . 0.0 111.851 -172.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -143.8 148.04 35.0 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.942 1.297 . . . . 0.0 109.071 167.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 49.8 mt -130.9 136.28 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.257 1.023 . . . . 0.0 110.095 -173.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 37.5 m -135.13 102.75 5.3 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.745 1.618 . . . . 0.0 110.652 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -59.32 150.47 25.97 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.024 0.93 . . . . 0.0 113.486 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 36.8 pt -135.28 -21.07 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.632 1.173 . . . . 0.0 113.874 170.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -152.27 178.97 8.94 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.684 1.194 . . . . 0.0 112.013 175.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -68.27 -14.09 62.73 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.752 1.221 . . . . 0.0 113.234 173.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.2 p -132.94 3.52 3.75 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.637 1.575 . . . . 0.0 113.769 -172.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 97.1 p -154.26 155.91 36.07 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 174.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.47 159.51 42.32 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.025 1.73 . . . . 0.0 111.61 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -89.8 150.16 22.38 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.68 0.792 . . . . 0.0 110.28 167.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 60.4 t -137.82 121.36 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.921 1.288 . . . . 0.0 110.235 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 74.7 m -89.12 142.37 27.7 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.871 1.268 . . . . 0.0 110.929 173.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 82.3 mt -125.54 155.69 40.22 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.441 1.496 . . . . 0.0 110.511 175.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 67.0 m -68.84 -24.26 64.35 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -171.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -144.85 154.7 55.61 Favored Pre-proline 0 N--CA 1.474 0.732 0 C-N-CA 124.875 1.27 . . . . 0.0 112.503 -177.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.07 -21.47 27.43 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.109 2.539 . . . . 0.0 113.007 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.33 -40.66 97.06 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.223 -0.923 . . . . 0.0 111.376 169.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -66.42 -39.9 89.23 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.308 -0.87 . . . . 0.0 111.54 177.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 93.3 t -59.06 -47.76 88.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.449 1.1 . . . . 0.0 110.837 171.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -62.3 -39.5 93.22 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.516 0.726 . . . . 0.0 112.812 177.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.84 -46.16 97.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.757 0.823 . . . . 0.0 111.02 174.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.3 -38.58 89.93 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.117 0.872 . . . . 0.0 112.882 177.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.1 t -66.58 -37.25 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.187 0.995 . . . . 0.0 112.088 172.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -71.22 -31.0 67.04 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.23 -0.919 . . . . 0.0 113.281 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 23.9 p -91.58 -18.8 23.5 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -174.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 67.5 p -67.37 -21.61 65.61 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -61.78 -13.06 20.21 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -134.54 27.91 3.67 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.184 1.794 . . . . 0.0 112.729 174.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -54.95 150.24 10.48 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.26 1.424 . . . . 0.0 113.798 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -72.17 -37.6 69.3 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.566 1.146 . . . . 0.0 113.8 -174.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 32.8 t -164.46 -39.86 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.078 1.351 . . . . 0.0 112.149 -178.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -62.69 172.77 1.5 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.846 1.658 . . . . 0.0 112.72 169.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -142.9 149.24 38.21 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.212 1.805 . . . . 0.0 110.218 171.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 72.3 mt -133.52 140.8 45.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 125.726 1.61 . . . . 0.0 109.254 -179.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -145.31 166.16 26.34 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.388 1.875 . . . . 0.0 110.186 173.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 30.2 p -71.16 163.52 27.46 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.454 -1.404 . . . . 0.0 112.226 173.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -54.43 -41.14 69.04 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.534 -0.729 . . . . 0.0 112.117 169.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.23 -39.18 89.36 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.873 0.869 . . . . 0.0 113.264 177.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -65.13 -34.09 77.57 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.277 -0.889 . . . . 0.0 112.831 174.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 81.2 t80 . . . . . 0 CA--C 1.542 0.648 0 C-N-CA 123.393 0.677 . . . . 0.0 112.238 171.457 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.49 0 N-CA-C 111.053 -0.819 . . . . 0.0 111.053 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 16.8 m -56.35 -16.84 6.27 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.397 1.479 . . . . 0.0 114.598 178.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 23.5 p -57.71 -24.15 55.4 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 126.565 1.946 . . . . 0.0 114.654 169.242 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 150.58 3.15 0.24 Allowed Glycine 0 CA--C 1.539 1.54 0 N-CA-C 117.458 1.743 . . . . 0.0 117.458 170.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 23.6 t -155.92 149.91 25.35 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 120.081 1.94 . . . . 0.0 113.095 -177.243 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 78.1 p -119.98 -0.35 10.62 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 126.435 1.894 . . . . 0.0 113.626 179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 108.76 -29.5 9.79 Favored Glycine 0 CA--C 1.536 1.365 0 C-N-CA 125.892 1.711 . . . . 0.0 114.191 176.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 164.74 175.07 35.16 Favored Glycine 0 CA--C 1.54 1.656 0 C-N-CA 124.695 1.141 . . . . 0.0 114.197 177.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 96.7 Cg_endo -77.32 -9.98 17.59 Favored 'Trans proline' 0 CA--C 1.544 1.025 0 C-N-CA 124.29 3.326 . . . . 0.0 114.031 179.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -65.36 169.38 5.92 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.819 1.648 . . . . 0.0 114.2 177.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 90.8 mt -123.78 25.4 8.08 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.605 1.562 . . . . 0.0 112.802 -169.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -60.49 158.38 30.32 Favored Pre-proline 0 CA--C 1.553 1.084 0 C-N-CA 124.528 1.131 . . . . 0.0 112.766 175.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_exo -51.4 157.15 5.02 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 124.222 3.281 . . . . 0.0 115.38 175.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -131.33 20.02 4.81 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 126.016 1.726 . . . . 0.0 113.813 -176.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -130.42 16.29 5.47 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 127.204 2.202 . . . . 0.0 112.755 -174.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 33.2 t70 -62.44 -19.04 63.09 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.575 1.15 . . . . 0.0 113.906 -179.47 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -96.98 12.35 32.77 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 127.143 2.177 . . . . 0.0 113.528 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 45.2 t -120.55 142.56 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.248 1.419 . . . . 0.0 110.995 -174.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 96.3 mt -113.35 163.48 14.8 Favored 'General case' 0 C--N 1.33 -0.249 0 C-N-CA 127.201 2.201 . . . . 0.0 111.352 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -123.0 138.71 54.62 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 127.043 2.137 . . . . 0.0 107.433 167.541 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 8.1 t -133.03 137.74 53.07 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.491 0 C-N-CA 124.794 1.237 . . . . 0.0 109.017 -169.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 15.8 m -127.35 135.52 50.63 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 124.816 1.246 . . . . 0.0 109.754 -178.036 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.1 p90 -158.08 158.61 30.12 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.772 1.229 . . . . 0.0 112.303 -169.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -53.42 148.12 34.87 Favored 'Trans proline' 0 CA--C 1.538 0.695 0 C-N-CA 123.844 3.029 . . . . 0.0 113.17 168.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -58.87 -16.16 16.07 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 115.737 1.755 . . . . 0.0 115.737 -176.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -82.36 -14.71 54.84 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.31 1.444 . . . . 0.0 113.948 177.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 8.9 m95 -62.62 148.72 45.41 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 119.129 0.877 . . . . 0.0 112.134 173.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 32.3 mtmm -129.69 165.91 20.9 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 125.962 1.705 . . . . 0.0 111.781 -175.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 m -50.51 -36.06 32.29 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.765 1.226 . . . . 0.0 112.42 172.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.1 m -65.89 -41.54 91.39 Favored 'General case' 0 N--CA 1.469 0.476 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 175.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 48.2 m-20 -64.82 -31.61 72.92 Favored 'General case' 0 N--CA 1.473 0.683 0 O-C-N 121.737 -0.602 . . . . 0.0 111.18 173.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.0 mt -72.62 -46.29 54.83 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 124.103 0.961 . . . . 0.0 111.573 177.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 20.2 m-85 -58.55 -38.33 77.59 Favored 'General case' 0 N--CA 1.47 0.544 0 O-C-N 121.23 -0.919 . . . . 0.0 112.48 169.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 24.3 tp60 -67.2 -39.74 86.38 Favored 'General case' 0 CA--C 1.542 0.67 0 CA-C-N 118.908 0.776 . . . . 0.0 112.879 175.48 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 41.7 tp -65.54 -44.16 87.72 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.792 1.237 . . . . 0.0 111.687 178.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -95.36 6.9 47.79 Favored 'General case' 0 CA--C 1.544 0.741 0 N-CA-C 113.923 1.083 . . . . 0.0 113.923 -175.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 8.7 t -55.18 -26.67 40.52 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.181 1.393 . . . . 0.0 113.413 173.801 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -61.06 -10.56 6.29 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.689 1.595 . . . . 0.0 114.973 174.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -122.68 8.03 9.46 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 125.501 1.52 . . . . 0.0 113.543 -174.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 80.8 -145.8 26.38 Favored Glycine 0 CA--C 1.535 1.321 0 O-C-N 121.239 -0.913 . . . . 0.0 113.213 179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 58.9 t30 -63.31 144.03 57.3 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 124.076 0.95 . . . . 0.0 112.401 175.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.9 pt -144.95 175.72 2.57 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 126.335 1.854 . . . . 0.0 111.491 -175.017 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -136.16 150.35 49.01 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 125.47 1.508 . . . . 0.0 109.392 168.443 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 69.0 mt -133.58 133.49 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 125.208 1.403 . . . . 0.0 109.227 -171.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 42.7 m -136.13 100.51 4.43 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 125.658 1.583 . . . . 0.0 111.196 -177.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 96.0 m95 -59.8 151.06 26.42 Favored 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 179.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 32.1 pt -135.09 -20.12 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.604 0 C-N-CA 124.837 1.255 . . . . 0.0 113.622 169.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -152.37 -179.12 7.27 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.66 1.184 . . . . 0.0 112.104 175.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 4.2 m-20 -64.33 -25.66 68.14 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.888 1.275 . . . . 0.0 112.719 170.094 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.7 p -125.29 4.13 7.78 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 125.949 1.699 . . . . 0.0 114.026 -169.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 93.4 p -154.58 156.16 36.05 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 114.824 1.416 . . . . 0.0 114.824 172.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.84 160.18 42.1 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.954 1.702 . . . . 0.0 111.459 -178.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -90.86 150.99 21.32 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.525 0.73 . . . . 0.0 110.108 167.726 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 68.6 t -138.66 126.6 28.3 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.913 0 C-N-CA 124.855 1.262 . . . . 0.0 109.896 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 9.4 t -95.28 137.38 34.41 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.504 1.122 . . . . 0.0 111.253 179.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 71.9 mt -122.54 158.75 29.2 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 126.066 1.747 . . . . 0.0 110.177 177.118 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 99.0 p -80.67 -9.85 59.77 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 -171.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 84.4 mt-30 -145.74 151.09 45.27 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.109 1.364 . . . . 0.0 111.915 177.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -71.57 -19.52 28.09 Favored 'Trans proline' 0 CA--C 1.543 0.963 0 C-N-CA 123.209 2.606 . . . . 0.0 113.308 172.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -65.13 -40.3 94.25 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 120.683 -1.261 . . . . 0.0 111.677 170.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -64.93 -39.04 92.89 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 123.734 0.814 . . . . 0.0 111.401 175.378 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 23.1 t -56.84 -50.71 74.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.368 1.067 . . . . 0.0 111.173 170.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 30.4 tt0 -60.48 -41.69 94.73 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 118.391 0.541 . . . . 0.0 112.311 179.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 81.1 mt -62.62 -47.11 94.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.862 0.865 . . . . 0.0 111.28 175.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.55 -40.71 97.68 Favored 'General case' 0 CA--C 1.543 0.71 0 CA-C-N 119.232 0.923 . . . . 0.0 112.874 178.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 77.9 t -66.97 -34.01 67.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 124.184 0.994 . . . . 0.0 112.172 175.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.5 t30 -70.28 -46.43 64.37 Favored 'General case' 0 CA--C 1.542 0.655 0 O-C-N 121.114 -0.991 . . . . 0.0 112.221 173.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 24.0 p -73.81 -25.22 59.99 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 -174.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 53.7 p -66.4 -19.71 65.87 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 114.712 1.375 . . . . 0.0 114.712 178.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -57.39 -22.38 42.46 Favored 'General case' 0 N--CA 1.48 1.027 0 C-N-CA 124.813 1.245 . . . . 0.0 113.746 174.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 26.5 m-85 -98.5 -5.62 31.88 Favored 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 125.198 1.399 . . . . 0.0 113.42 -179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -77.17 145.5 37.64 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.482 1.113 . . . . 0.0 112.562 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.0 pt-20 -129.76 0.46 4.87 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.908 1.283 . . . . 0.0 114.286 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 46.6 m -126.61 0.86 6.84 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 125.809 1.644 . . . . 0.0 112.986 177.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 52.1 p90 -161.22 171.63 18.1 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.524 2.33 . . . . 0.0 109.741 175.71 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 18.3 tpp85 -148.64 155.13 40.65 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.855 1.262 . . . . 0.0 111.127 169.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 73.9 mt -134.66 141.59 42.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 126.052 1.741 . . . . 0.0 109.387 -173.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.0 pt20 -145.96 168.68 20.28 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.259 1.824 . . . . 0.0 110.557 172.237 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 30.4 p -71.62 163.03 28.52 Favored 'General case' 0 N--CA 1.481 1.119 0 O-C-N 120.662 -1.274 . . . . 0.0 112.347 173.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 45.6 t80 -57.21 -40.8 78.18 Favored 'General case' 0 CA--C 1.543 0.704 0 O-C-N 121.263 -0.898 . . . . 0.0 111.733 169.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.19 -36.73 85.12 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 123.763 0.825 . . . . 0.0 113.03 177.704 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 28.9 mt-10 -64.38 -42.31 96.21 Favored 'General case' 0 N--CA 1.469 0.501 0 O-C-N 121.235 -0.916 . . . . 0.0 112.212 171.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 90.4 t80 -59.18 -46.55 88.12 Favored 'General case' 0 CA--C 1.542 0.635 0 CA-C-N 119.03 0.832 . . . . 0.0 111.989 174.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 34.7 t -58.78 -44.75 90.96 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 C-N-CA 124.546 1.138 . . . . 0.0 112.033 173.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -70.87 -9.07 65.37 Favored Glycine 0 CA--C 1.539 1.579 0 C-N-CA 124.372 0.987 . . . . 0.0 115.007 -179.837 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 82.0 mttt -117.69 8.5 12.8 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 127.113 2.165 . . . . 0.0 112.829 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 39.3 ttpt -53.58 -27.78 28.36 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 126.703 2.001 . . . . 0.0 114.23 -177.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 8.0 pm0 -70.62 47.38 0.1 Allowed 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 127.49 2.316 . . . . 0.0 113.169 169.009 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -48.96 -38.45 23.09 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 127.582 2.353 . . . . 0.0 115.935 -168.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 53.8 41.26 66.29 Favored Glycine 0 CA--C 1.538 1.514 0 C-N-CA 124.468 1.032 . . . . 0.0 114.144 179.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 36.6 ttpt -49.69 -40.33 39.85 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 126.568 1.947 . . . . 0.0 115.148 -169.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 44.1 mt-30 -140.14 157.48 45.56 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.105 1.362 . . . . 0.0 111.735 -178.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 6.7 p -131.76 1.55 1.84 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.126 0 C-N-CA 125.027 1.331 . . . . 0.0 113.948 -169.56 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -56.9 -35.47 69.01 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.649 1.18 . . . . 0.0 112.91 176.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 69.4 m -145.05 -39.62 0.25 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.535 1.934 . . . . 0.0 111.227 169.616 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 156.02 175.92 27.56 Favored Glycine 0 CA--C 1.538 1.514 0 C-N-CA 125.793 1.663 . . . . 0.0 112.685 173.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 59.8 Cg_endo -65.8 -20.29 58.76 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.435 2.756 . . . . 0.0 113.198 176.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 19.8 m -66.9 -8.94 32.87 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.423 1.489 . . . . 0.0 114.261 170.282 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 19.6 m -132.6 8.59 4.22 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 125.762 1.625 . . . . 0.0 113.515 -171.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.101 0 C-N-CA 125.323 1.44 . . . . 0.0 112.713 -178.625 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.914 0 C5'-C4'-O4' 112.767 2.548 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.491 0 N-CA-C 111.76 -0.536 . . . . 0.0 111.76 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 17.3 t -152.95 162.43 41.33 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.228 1.411 . . . . 0.0 111.725 178.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 28.7 m -69.19 -10.0 55.63 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 125.538 1.535 . . . . 0.0 114.575 178.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -170.18 -176.8 40.0 Favored Glycine 0 CA--C 1.535 1.297 0 C-N-CA 125.004 1.287 . . . . 0.0 113.797 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 79.2 p -136.99 10.08 3.05 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.407 1.483 . . . . 0.0 114.245 -173.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 8.5 t -149.32 173.06 13.92 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 126.032 1.733 . . . . 0.0 111.079 179.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -169.01 178.51 42.24 Favored Glycine 0 CA--C 1.535 1.292 0 C-N-CA 124.134 0.873 . . . . 0.0 114.937 -177.315 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 171.64 -165.75 38.67 Favored Glycine 0 CA--C 1.54 1.641 0 C-N-CA 125.692 1.615 . . . . 0.0 112.115 -174.404 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -72.06 -15.13 29.15 Favored 'Trans proline' 0 CA--C 1.543 0.967 0 C-N-CA 122.959 2.44 . . . . 0.0 113.703 175.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -79.62 -2.56 43.16 Favored 'General case' 0 CA--C 1.549 0.908 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 -171.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.1 9.73 26.17 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.303 1.441 . . . . 0.0 114.461 -176.65 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -58.72 148.07 68.98 Favored Pre-proline 0 CA--C 1.551 1.004 0 C-N-CA 124.101 0.961 . . . . 0.0 112.356 174.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_endo -77.21 -7.33 17.08 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.653 2.902 . . . . 0.0 114.59 -175.567 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 49.0 mttm -58.99 152.09 20.55 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -176.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.9 mmt-85 -138.8 11.77 2.68 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 126.895 2.078 . . . . 0.0 112.927 176.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 57.4 m-20 -58.74 -19.54 41.23 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.161 1.384 . . . . 0.0 113.731 179.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 27.8 p-80 -115.34 16.61 16.76 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.588 2.355 . . . . 0.0 112.904 -175.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 42.9 t -123.1 138.47 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 C-N-CA 124.677 1.191 . . . . 0.0 112.165 -170.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 76.8 mt -118.22 164.3 15.38 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 127.191 2.196 . . . . 0.0 110.839 175.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 13.8 t-80 -118.09 141.96 47.92 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.802 2.041 . . . . 0.0 107.908 167.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.7 t -133.16 139.25 49.77 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 C-N-CA 125.556 1.542 . . . . 0.0 109.107 -171.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.5 m -128.14 134.87 49.15 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 125.346 1.458 . . . . 0.0 109.594 -178.458 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 5.9 p90 -158.32 158.58 29.85 Favored Pre-proline 0 CA--C 1.544 0.725 0 C-N-CA 124.715 1.206 . . . . 0.0 111.539 -170.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 33.9 Cg_endo -66.17 151.16 84.31 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 122.061 1.841 . . . . 0.0 111.065 169.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 13.3 ptpt -60.65 -11.72 8.14 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -178.613 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -66.68 -19.81 65.84 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.47 1.108 . . . . 0.0 113.522 171.297 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -73.61 153.31 40.24 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 124.285 1.034 . . . . 0.0 112.758 175.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.13 173.46 11.2 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 126.6 1.96 . . . . 0.0 111.691 175.456 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.8 m -49.12 -35.77 17.25 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 125.197 1.399 . . . . 0.0 112.395 171.538 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.7 m -64.5 -43.31 94.51 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 113.777 1.029 . . . . 0.0 113.777 176.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 22.2 m-20 -65.92 -31.61 72.64 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 121.653 -0.654 . . . . 0.0 111.187 174.769 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.0 mt -71.44 -43.7 66.21 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 123.868 0.867 . . . . 0.0 111.502 175.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 22.2 m-85 -58.68 -42.43 88.51 Favored 'General case' 0 CA--C 1.538 0.509 0 O-C-N 120.943 -1.098 . . . . 0.0 111.753 169.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 44.6 tt0 -62.81 -33.82 76.02 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 119.035 0.834 . . . . 0.0 112.971 176.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.2 tp -73.37 -29.93 62.95 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.789 1.236 . . . . 0.0 113.369 177.207 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 75.9 m-85 -121.06 -0.2 10.06 Favored 'General case' 0 CA--C 1.548 0.868 0 N-CA-C 115.66 1.726 . . . . 0.0 115.66 -169.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 78.0 p -56.88 -23.91 48.03 Favored 'General case' 0 N--CA 1.481 1.082 0 N-CA-C 114.721 1.378 . . . . 0.0 114.721 176.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -57.71 -17.07 13.03 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 125.469 1.508 . . . . 0.0 114.545 174.378 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -99.56 3.71 45.54 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.218 1.407 . . . . 0.0 113.99 -178.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.67 -44.1 3.04 Favored Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.955 1.741 . . . . 0.0 115.817 168.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 -150.16 133.84 16.7 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 124.878 1.271 . . . . 0.0 110.594 177.481 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.9 pt -146.1 173.25 3.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 C-N-CA 125.018 1.327 . . . . 0.0 112.101 -172.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 62.8 tp60 -139.92 139.1 36.1 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.002 1.321 . . . . 0.0 108.817 167.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 71.8 mt -112.94 132.36 61.95 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 C-N-CA 125.11 1.364 . . . . 0.0 108.279 -179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 57.9 m -141.03 95.97 2.93 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.258 1.423 . . . . 0.0 111.095 -174.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 85.8 m95 -57.97 152.68 15.81 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -177.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 37.7 pt -134.26 -19.8 0.79 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.66 0 C-N-CA 125.21 1.404 . . . . 0.0 113.398 169.185 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -153.64 178.27 10.04 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 124.733 1.213 . . . . 0.0 111.994 174.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -63.61 -17.42 62.86 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 126.36 1.864 . . . . 0.0 112.733 171.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.2 p -135.07 7.59 3.42 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 127.197 2.199 . . . . 0.0 113.64 -171.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 4.0 m -149.66 146.37 27.23 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.21 1.004 . . . . 0.0 113.693 179.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.44 158.98 43.4 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.189 1.395 . . . . 0.0 112.04 175.79 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -90.38 152.75 20.86 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 123.75 0.82 . . . . 0.0 109.726 167.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.0 t -136.11 115.05 15.85 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 C-N-CA 124.231 1.012 . . . . 0.0 110.42 173.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 24.0 m -79.21 143.36 35.42 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 125.248 1.419 . . . . 0.0 109.831 169.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 76.7 mt -119.7 161.6 20.44 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.938 1.295 . . . . 0.0 111.092 175.838 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 21.1 t -60.32 -34.84 74.39 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.627 1.171 . . . . 0.0 113.673 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 79.7 mt-30 -140.32 151.53 64.55 Favored Pre-proline 0 CA--C 1.545 0.763 0 C-N-CA 125.179 1.392 . . . . 0.0 111.684 -177.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -69.21 -23.71 32.99 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.129 2.553 . . . . 0.0 113.868 -178.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 38.5 tt0 -62.72 -33.64 75.53 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 120.863 -1.148 . . . . 0.0 112.387 173.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 93.8 mt-30 -66.1 -27.71 68.26 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.284 1.033 . . . . 0.0 112.785 -179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 90.0 t -61.93 -46.56 96.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.776 1.23 . . . . 0.0 110.617 173.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -63.53 -41.25 98.48 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.642 0.777 . . . . 0.0 111.699 176.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 97.3 mt -60.32 -51.32 74.34 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 123.652 0.781 . . . . 0.0 110.528 175.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -60.86 -39.89 90.88 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 113.282 0.845 . . . . 0.0 113.282 179.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.8 t -62.77 -36.72 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 O-C-N 121.025 -1.047 . . . . 0.0 111.754 173.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -73.11 -30.57 63.74 Favored 'General case' 0 CA--C 1.545 0.771 0 N-CA-C 113.866 1.061 . . . . 0.0 113.866 176.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -91.48 -33.06 15.35 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 113.566 0.951 . . . . 0.0 113.566 -176.604 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 90.0 p -70.08 -17.75 63.24 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 50.7 pttt -59.93 -12.07 7.0 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 115.162 1.541 . . . . 0.0 115.162 179.452 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -101.01 1.31 39.44 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 125.898 1.679 . . . . 0.0 113.968 178.023 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -61.85 159.26 14.2 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 124.63 1.172 . . . . 0.0 113.958 -179.336 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -136.82 -1.93 2.18 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 125.033 1.333 . . . . 0.0 114.57 -178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 78.2 p -140.81 1.48 1.69 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.446 1.498 . . . . 0.0 114.172 -176.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -156.75 175.43 14.07 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.038 2.135 . . . . 0.0 109.983 177.7 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 76.6 ttt-85 -145.85 150.89 36.98 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 125.351 1.46 . . . . 0.0 110.895 172.479 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 85.0 mt -131.88 144.93 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.658 0 C-N-CA 126.18 1.792 . . . . 0.0 109.577 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -150.27 169.27 21.76 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.735 1.614 . . . . 0.0 110.747 169.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 59.9 p -71.06 162.63 29.1 Favored 'General case' 0 N--CA 1.478 0.972 0 O-C-N 120.815 -1.178 . . . . 0.0 112.229 174.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -58.13 -37.57 74.86 Favored 'General case' 0 CA--C 1.545 0.775 0 O-C-N 121.386 -0.821 . . . . 0.0 112.085 169.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.71 -38.39 89.05 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 123.76 0.824 . . . . 0.0 113.0 175.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -67.66 -39.18 84.56 Favored 'General case' 0 N--CA 1.47 0.561 0 O-C-N 121.117 -0.989 . . . . 0.0 112.545 172.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 26.2 t80 -57.95 -47.04 84.09 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 123.775 0.83 . . . . 0.0 111.737 172.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 27.2 t -58.97 -43.43 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 124.639 1.176 . . . . 0.0 112.172 171.497 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -63.82 -25.4 69.11 Favored Glycine 0 CA--C 1.536 1.349 0 C-N-CA 124.643 1.115 . . . . 0.0 115.298 -172.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 12.4 mptt -81.72 -45.21 16.0 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 118.9 1.35 . . . . 0.0 111.808 168.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 27.3 mtpp -60.21 -31.08 69.82 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 125.409 1.484 . . . . 0.0 114.793 -172.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 21.7 pt20 -59.71 -18.77 45.26 Favored 'General case' 0 CA--C 1.549 0.91 0 N-CA-C 114.915 1.45 . . . . 0.0 114.915 175.589 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 39.2 ttmt -100.11 -13.8 18.83 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.522 1.529 . . . . 0.0 113.235 176.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -84.46 52.71 4.74 Favored Glycine 0 CA--C 1.535 1.286 0 C-N-CA 126.077 1.799 . . . . 0.0 114.238 -175.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -140.81 154.09 46.09 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 125.613 1.565 . . . . 0.0 111.937 -174.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 19.3 pt20 -144.83 174.14 11.25 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.94 1.696 . . . . 0.0 112.002 179.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.8 m -127.44 18.04 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.235 0 C-N-CA 125.461 1.504 . . . . 0.0 113.2 -172.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 65.4 pttt -141.86 169.89 16.75 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 126.317 1.847 . . . . 0.0 112.391 -178.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 8.0 t -144.92 -177.59 5.6 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.607 1.563 . . . . 0.0 112.028 -176.137 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -126.72 67.67 0.54 Allowed Glycine 0 CA--C 1.537 1.447 0 C-N-CA 126.54 2.019 . . . . 0.0 112.906 -175.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -67.14 -10.92 30.29 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 123.905 3.07 . . . . 0.0 114.569 -175.67 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 45.6 p -68.3 -20.24 64.75 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.204 1.402 . . . . 0.0 114.248 172.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 71.5 m -65.89 153.42 42.06 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 124.494 1.117 . . . . 0.0 112.987 175.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.268 0 C-N-CA 125.152 1.358 . . . . 0.0 112.825 178.251 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.766 0 C5'-C4'-O4' 113.112 2.794 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.538 0 N-CA-C 110.758 -0.937 . . . . 0.0 110.758 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 23.3 m 52.3 29.08 6.29 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 125.558 1.543 . . . . 0.0 114.035 -173.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 9.7 m -62.83 -20.78 65.39 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.068 1.747 . . . . 0.0 115.381 -169.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -68.94 -27.25 74.06 Favored Glycine 0 CA--C 1.538 1.484 0 C-N-CA 124.066 0.841 . . . . 0.0 114.218 177.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 49.0 m -66.42 -21.53 66.21 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 113.95 1.092 . . . . 0.0 113.95 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 43.0 m -64.59 -12.81 49.23 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 115.449 1.648 . . . . 0.0 115.449 -175.555 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -131.51 8.74 5.58 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.776 1.179 . . . . 0.0 115.269 -178.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 39.21 54.54 2.55 Favored Glycine 0 CA--C 1.546 1.995 0 C-N-CA 126.249 1.88 . . . . 0.0 116.817 178.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -66.68 166.49 22.03 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 123.597 2.865 . . . . 0.0 113.171 -177.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -140.7 174.7 10.26 Favored 'General case' 0 CA--C 1.545 0.771 0 C-N-CA 124.889 1.276 . . . . 0.0 113.761 -178.558 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.09 4.63 33.23 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 115.679 1.733 . . . . 0.0 115.679 -171.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 63.3 mt-30 -58.46 131.44 85.05 Favored Pre-proline 0 CA--C 1.55 0.973 0 CA-C-N 119.484 1.038 . . . . 0.0 112.188 -175.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -78.47 -7.12 15.82 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 123.662 2.908 . . . . 0.0 114.306 -176.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -138.36 156.68 47.38 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 126.191 1.796 . . . . 0.0 111.271 -174.787 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -135.99 8.82 3.26 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 126.053 1.741 . . . . 0.0 113.1 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -63.53 -23.85 67.56 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.569 1.147 . . . . 0.0 113.442 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 44.6 p-80 -93.71 17.57 11.65 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 127.502 2.321 . . . . 0.0 113.584 176.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 24.6 t -126.52 135.88 62.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.868 0 C-N-CA 124.813 1.245 . . . . 0.0 111.399 -170.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 89.7 mt -103.11 167.0 10.11 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 126.693 1.997 . . . . 0.0 111.8 174.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 33.2 t-80 -122.95 135.69 54.58 Favored 'General case' 0 C--N 1.327 -0.391 0 C-N-CA 127.376 2.27 . . . . 0.0 107.224 167.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.4 t -131.35 140.16 49.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 124.797 1.239 . . . . 0.0 109.084 -171.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 9.9 m -131.18 136.62 48.45 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 125.041 1.336 . . . . 0.0 109.76 -178.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -158.91 158.74 29.34 Favored Pre-proline 0 CA--C 1.55 0.952 0 C-N-CA 124.477 1.111 . . . . 0.0 112.415 -169.708 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_exo -53.79 148.72 35.89 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.79 2.993 . . . . 0.0 113.281 169.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 8.6 ptpp? -61.11 -9.33 4.44 Favored 'General case' 0 N--CA 1.482 1.148 0 N-CA-C 115.847 1.795 . . . . 0.0 115.847 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -85.02 -12.23 53.62 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.333 1.453 . . . . 0.0 113.931 177.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 7.9 m95 -63.61 157.7 23.17 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.333 0.864 . . . . 0.0 113.333 175.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 31.9 mmmt -131.52 162.93 29.11 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.577 1.951 . . . . 0.0 111.651 -178.369 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.6 m -52.74 -35.95 56.96 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 124.763 1.225 . . . . 0.0 111.999 169.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.2 m -66.37 -41.52 89.34 Favored 'General case' 0 N--CA 1.465 0.323 0 N-CA-C 113.496 0.925 . . . . 0.0 113.496 176.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -65.28 -30.68 71.57 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.792 -0.567 . . . . 0.0 111.393 173.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 62.0 mt -70.71 -47.31 60.45 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 123.867 0.867 . . . . 0.0 111.479 175.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -58.41 -38.93 78.4 Favored 'General case' 0 CA--C 1.539 0.549 0 O-C-N 120.99 -1.069 . . . . 0.0 112.452 170.441 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -65.91 -39.34 90.5 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.072 0.851 . . . . 0.0 112.844 175.438 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.8 tp -62.38 -33.84 75.53 Favored 'General case' 0 CA--C 1.541 0.604 0 C-N-CA 125.243 1.417 . . . . 0.0 112.11 176.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -110.85 9.8 22.47 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 114.711 1.374 . . . . 0.0 114.711 -174.385 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 32.8 m -57.97 -22.06 47.38 Favored 'General case' 0 N--CA 1.478 0.953 0 O-C-N 121.03 -1.044 . . . . 0.0 113.771 173.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.08 -15.23 12.8 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 125.435 1.494 . . . . 0.0 114.685 171.218 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -113.33 4.01 16.19 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.587 1.555 . . . . 0.0 113.627 -178.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.68 -44.95 2.82 Favored Glycine 0 CA--C 1.534 1.27 0 C-N-CA 126.0 1.762 . . . . 0.0 115.242 172.536 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 -153.3 144.38 22.97 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 124.826 1.25 . . . . 0.0 111.894 178.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 15.4 pt -145.35 176.03 2.23 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 126.349 1.86 . . . . 0.0 111.611 178.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -136.85 145.23 44.17 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.944 1.298 . . . . 0.0 109.415 168.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 76.2 mt -123.51 134.51 66.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 124.438 1.095 . . . . 0.0 110.051 -169.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.4 m -134.33 96.89 3.69 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 126.216 1.806 . . . . 0.0 109.966 179.071 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -55.83 155.8 5.69 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.475 1.11 . . . . 0.0 113.88 -179.677 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 12.7 mt -128.49 -39.07 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.967 1.307 . . . . 0.0 109.959 178.206 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -153.67 -172.4 4.22 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.71 1.604 . . . . 0.0 110.52 174.27 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -63.93 -17.75 63.54 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 124.687 1.195 . . . . 0.0 113.073 172.254 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.9 p -127.41 2.87 6.28 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 126.433 1.893 . . . . 0.0 114.332 -169.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 80.1 p -153.73 153.92 33.11 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 114.272 1.212 . . . . 0.0 114.272 174.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.94 151.73 31.6 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 125.45 1.5 . . . . 0.0 111.86 -179.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -89.59 145.87 24.96 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.936 0.894 . . . . 0.0 108.86 167.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.4 t -137.88 111.26 7.83 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.749 0 C-N-CA 123.86 0.864 . . . . 0.0 110.984 -176.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 66.5 m -75.87 138.31 41.0 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 125.917 1.687 . . . . 0.0 110.955 171.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 49.5 mt -112.61 163.39 14.58 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.303 1.041 . . . . 0.0 112.199 178.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 17.6 t -64.37 -34.04 77.25 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 124.252 1.021 . . . . 0.0 113.318 -179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 87.2 mt-30 -141.11 149.49 55.69 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 125.333 1.453 . . . . 0.0 111.21 -179.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -70.44 -24.65 26.32 Favored 'Trans proline' 0 CA--C 1.539 0.742 0 C-N-CA 122.95 2.433 . . . . 0.0 113.991 -177.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 12.7 pt-20 -65.52 -27.03 68.17 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 120.754 -1.216 . . . . 0.0 113.39 174.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.0 mt-30 -67.43 -26.14 66.27 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.434 1.094 . . . . 0.0 112.272 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.5 t -61.78 -45.38 98.81 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 124.936 1.294 . . . . 0.0 110.257 176.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -65.25 -39.63 92.92 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.79 0.836 . . . . 0.0 111.825 177.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 99.3 mt -60.96 -49.67 83.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 123.91 0.884 . . . . 0.0 110.573 175.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.82 -39.15 93.42 Favored 'General case' 0 CA--C 1.541 0.623 0 N-CA-C 113.518 0.933 . . . . 0.0 113.518 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 74.8 t -63.66 -40.62 89.73 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.427 -0.795 . . . . 0.0 110.961 173.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -64.05 -45.13 90.17 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 118.889 0.768 . . . . 0.0 112.836 175.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -72.9 -27.5 61.92 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.543 0.942 . . . . 0.0 113.543 -176.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 31.7 p -62.77 -19.76 64.31 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 115.116 1.525 . . . . 0.0 115.116 178.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 58.3 mtmt -60.07 -12.6 8.64 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 125.245 1.418 . . . . 0.0 114.011 171.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 33.2 m-85 -121.0 12.09 11.11 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.009 1.723 . . . . 0.0 112.699 -176.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.72 164.37 10.0 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.661 1.185 . . . . 0.0 113.061 172.597 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -132.98 -13.37 2.81 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.141 1.376 . . . . 0.0 113.085 178.179 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 71.1 p -145.84 7.71 1.09 Allowed 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.114 1.365 . . . . 0.0 114.682 -170.448 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -157.72 175.06 14.39 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.978 1.711 . . . . 0.0 111.418 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 63.2 ttm-85 -146.4 149.66 34.18 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.219 1.808 . . . . 0.0 110.507 172.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 88.0 mt -133.87 145.67 32.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.853 1.661 . . . . 0.0 109.605 -178.076 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.2 pt20 -149.73 170.43 18.74 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.128 1.771 . . . . 0.0 110.36 169.615 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 25.4 p -72.08 164.51 26.03 Favored 'General case' 0 N--CA 1.48 1.028 0 O-C-N 120.536 -1.352 . . . . 0.0 112.191 173.028 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 41.2 t80 -55.34 -41.79 72.96 Favored 'General case' 0 CA--C 1.545 0.754 0 O-C-N 121.273 -0.892 . . . . 0.0 111.934 169.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -69.38 -38.13 77.89 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 123.859 0.864 . . . . 0.0 113.213 178.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -61.44 -41.31 97.0 Favored 'General case' 0 N--CA 1.47 0.532 0 C-N-CA 123.841 0.856 . . . . 0.0 111.962 173.649 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -61.0 -52.19 66.06 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 118.383 0.538 . . . . 0.0 111.843 172.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 25.0 t -54.81 -44.15 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 124.216 1.007 . . . . 0.0 112.312 178.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -69.94 -9.14 62.46 Favored Glycine 0 CA--C 1.54 1.611 0 C-N-CA 124.348 0.975 . . . . 0.0 115.243 -179.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 77.0 mttt -114.52 -12.69 12.26 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.241 1.816 . . . . 0.0 113.055 177.405 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -58.53 -39.38 79.99 Favored 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 126.52 1.928 . . . . 0.0 113.692 -175.435 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 74.8 mm-40 -145.98 -48.81 0.21 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.85 1.26 . . . . 0.0 112.958 176.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 63.7 pttt -157.05 169.54 24.58 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.005 1.322 . . . . 0.0 113.004 -172.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -168.16 177.46 42.29 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.466 1.508 . . . . 0.0 113.237 176.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -66.36 167.14 11.01 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 125.289 1.436 . . . . 0.0 113.239 179.22 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -134.26 155.35 50.33 Favored 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 125.864 1.666 . . . . 0.0 111.346 178.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.9 m -73.32 -16.89 17.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.129 0 N-CA-C 115.016 1.487 . . . . 0.0 115.016 -173.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -150.62 149.73 30.24 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.352 1.461 . . . . 0.0 111.589 -176.456 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 70.9 m -142.15 166.13 25.55 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 126.642 1.977 . . . . 0.0 111.007 175.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -175.49 171.92 44.98 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 124.431 1.015 . . . . 0.0 113.697 176.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -75.65 -20.67 15.39 Favored 'Trans proline' 0 CA--C 1.543 0.927 0 C-N-CA 123.701 2.934 . . . . 0.0 114.0 -176.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 86.6 p -157.25 169.36 24.94 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.638 1.575 . . . . 0.0 112.103 -177.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 43.3 m -132.98 9.3 4.14 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.203 1.401 . . . . 0.0 113.826 -177.414 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.186 0 C-N-CA 125.382 1.467 . . . . 0.0 112.714 -178.748 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.418 -2.878 0 O5'-C5'-C4' 113.77 2.55 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.534 0 N-CA-C 111.716 -0.554 . . . . 0.0 111.716 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 22.6 m -132.85 8.36 4.12 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 -171.352 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 17.9 t -60.01 -31.92 70.39 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.644 1.177 . . . . 0.0 113.249 178.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -64.22 -10.51 41.64 Favored Glycine 0 CA--C 1.542 1.721 0 C-N-CA 124.971 1.272 . . . . 0.0 115.133 172.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 45.7 m -129.22 19.1 5.91 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 126.843 2.057 . . . . 0.0 111.799 177.433 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 25.5 m 52.25 21.21 1.57 Allowed 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 126.885 2.074 . . . . 0.0 115.291 -177.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 69.06 2.24 30.38 Favored Glycine 0 CA--C 1.541 1.658 0 C-N-CA 125.037 1.303 . . . . 0.0 115.698 -174.158 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 154.82 177.84 28.54 Favored Glycine 0 CA--C 1.542 1.752 0 CA-C-N 119.09 1.445 . . . . 0.0 114.152 -178.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.38 173.76 11.05 Favored 'Trans proline' 0 CA--C 1.543 0.946 0 C-N-CA 124.143 3.228 . . . . 0.0 113.107 177.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -70.98 1.78 5.21 Favored 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 125.974 1.709 . . . . 0.0 115.59 -179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.7 pp -143.68 176.49 9.18 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 126.379 1.872 . . . . 0.0 112.21 -178.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 25.2 pt20 -147.71 140.22 14.54 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 124.536 1.134 . . . . 0.0 111.684 177.353 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_exo -59.64 -34.38 96.48 Favored 'Trans proline' 0 C--N 1.354 0.846 0 C-N-CA 123.539 2.826 . . . . 0.0 116.139 -176.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 13.6 mmmm -141.35 173.09 11.82 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 126.101 1.76 . . . . 0.0 112.321 -169.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 29.6 mmt180 -130.35 14.48 5.57 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 126.813 2.045 . . . . 0.0 113.377 -174.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 30.9 m-20 -60.34 -14.21 17.24 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 125.395 1.478 . . . . 0.0 114.524 -179.28 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 46.3 p-80 -117.3 18.05 14.54 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 128.154 2.582 . . . . 0.0 112.44 -177.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 26.6 t -123.92 143.75 36.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 125.239 1.416 . . . . 0.0 111.267 -174.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 70.8 mt -121.88 166.54 14.25 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 127.462 2.305 . . . . 0.0 110.672 -179.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -125.21 142.82 51.27 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 126.641 1.977 . . . . 0.0 108.395 168.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -135.64 142.46 39.3 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.568 0 C-N-CA 124.836 1.254 . . . . 0.0 109.558 -169.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 2.0 m -129.65 137.4 50.64 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.119 1.368 . . . . 0.0 109.796 -179.44 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.2 p90 -159.36 157.3 27.01 Favored Pre-proline 0 CA--C 1.549 0.938 0 C-N-CA 124.413 1.085 . . . . 0.0 112.371 -169.155 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_exo -54.52 143.85 65.65 Favored 'Trans proline' 0 CA--C 1.538 0.708 0 C-N-CA 123.721 2.947 . . . . 0.0 112.75 169.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -55.61 -25.38 38.38 Favored 'General case' 0 N--CA 1.484 1.235 0 N-CA-C 114.874 1.435 . . . . 0.0 114.874 -178.073 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -65.95 -13.41 59.72 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.562 1.545 . . . . 0.0 114.356 177.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 10.7 m95 -69.14 156.37 38.8 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.321 1.048 . . . . 0.0 112.784 172.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.6 mptt -128.99 171.17 12.61 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 126.538 1.935 . . . . 0.0 110.969 174.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.0 m -52.41 -32.55 39.58 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 125.025 1.33 . . . . 0.0 111.757 169.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.3 m -64.46 -43.23 94.88 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 114.041 1.126 . . . . 0.0 114.041 173.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 27.1 m-20 -66.48 -30.99 71.44 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 121.572 -0.705 . . . . 0.0 111.277 174.528 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 74.9 mt -70.15 -43.77 70.19 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.639 0.776 . . . . 0.0 111.408 173.813 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -58.5 -39.91 81.35 Favored 'General case' 0 N--CA 1.469 0.491 0 O-C-N 120.854 -1.154 . . . . 0.0 112.196 169.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -65.83 -34.51 78.31 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-N 119.126 0.875 . . . . 0.0 113.038 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 58.3 tp -70.64 -31.03 67.83 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.595 1.158 . . . . 0.0 113.056 176.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -117.22 6.03 12.74 Favored 'General case' 0 CA--C 1.548 0.877 0 N-CA-C 114.87 1.433 . . . . 0.0 114.87 -171.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 78.2 p -57.67 -25.29 60.02 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 178.004 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.16 -15.65 15.82 Favored 'General case' 0 CA--C 1.548 0.895 0 C-N-CA 125.549 1.54 . . . . 0.0 114.662 176.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 43.8 m-85 -101.8 3.07 39.04 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 125.108 1.363 . . . . 0.0 114.069 -176.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 83.89 -48.72 4.1 Favored Glycine 0 CA--C 1.533 1.212 0 C-N-CA 125.906 1.717 . . . . 0.0 114.998 169.48 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 62.2 t30 -152.13 140.18 20.2 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.805 1.242 . . . . 0.0 111.113 176.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 30.5 pt -146.0 174.94 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.925 1.69 . . . . 0.0 111.842 -171.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 8.0 tm0? -139.91 139.54 36.22 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.978 1.311 . . . . 0.0 108.612 169.153 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 72.5 mt -120.84 130.07 75.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.879 1.272 . . . . 0.0 109.448 -175.029 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.3 m -134.78 99.61 4.37 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 125.335 1.454 . . . . 0.0 111.335 -176.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -57.4 152.26 14.74 Favored 'General case' 0 N--CA 1.468 0.471 0 C-N-CA 124.768 1.227 . . . . 0.0 113.666 175.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 19.6 pt -134.15 -25.86 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.615 0 C-N-CA 124.77 1.228 . . . . 0.0 113.173 169.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -156.0 179.32 9.33 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.048 1.339 . . . . 0.0 112.114 169.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -65.88 -14.09 60.84 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 115.653 1.723 . . . . 0.0 115.653 -175.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 50.1 p -132.46 6.44 4.11 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 125.295 1.438 . . . . 0.0 113.603 -177.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 1.1 p -150.92 152.15 33.2 Favored 'General case' 0 CA--C 1.541 0.619 0 N-CA-C 114.464 1.283 . . . . 0.0 114.464 173.17 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -155.34 159.45 39.95 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 125.372 1.469 . . . . 0.0 111.87 -174.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.87 152.48 21.23 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 123.426 0.69 . . . . 0.0 110.769 168.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 59.6 t -137.21 116.25 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 C-N-CA 124.954 1.301 . . . . 0.0 109.748 174.645 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 8.4 t -85.08 140.85 30.67 Favored 'General case' 0 N--CA 1.468 0.427 0 C-N-CA 124.961 1.304 . . . . 0.0 110.53 172.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 60.9 mt -117.77 165.05 14.1 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.235 1.414 . . . . 0.0 111.548 179.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 9.4 t -62.97 -32.38 73.7 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.399 1.08 . . . . 0.0 113.864 -173.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -152.67 157.34 33.44 Favored Pre-proline 0 CA--C 1.547 0.864 0 C-N-CA 124.193 0.997 . . . . 0.0 112.919 175.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -53.13 -33.24 63.1 Favored 'Trans proline' 0 C--N 1.354 0.826 0 C-N-CA 124.393 3.395 . . . . 0.0 115.517 178.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -58.21 -35.65 71.96 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 113.29 0.848 . . . . 0.0 113.29 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -70.0 -23.4 63.13 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.405 1.082 . . . . 0.0 113.262 -177.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 99.0 t -59.48 -44.22 92.39 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.902 0 C-N-CA 125.155 1.382 . . . . 0.0 111.094 177.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 4.4 mp0 -66.57 -34.95 79.05 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.594 0.758 . . . . 0.0 112.061 178.617 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 59.8 mt -64.96 -48.15 85.27 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.622 0 C-N-CA 123.696 0.798 . . . . 0.0 110.212 176.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.95 -38.51 91.34 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 177.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.3 t -63.97 -40.22 88.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 121.31 -0.869 . . . . 0.0 111.361 173.126 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 25.6 t-20 -61.09 -49.92 75.34 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.03 0.832 . . . . 0.0 112.201 172.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.0 p -67.3 -27.01 66.82 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 -174.693 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 9.4 t -64.27 -19.7 65.57 Favored 'General case' 0 N--CA 1.472 0.668 0 N-CA-C 114.27 1.211 . . . . 0.0 114.27 171.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -60.78 -18.82 57.42 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.519 1.128 . . . . 0.0 113.147 172.497 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 -117.33 7.69 12.92 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 125.858 1.663 . . . . 0.0 112.762 -175.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.22 156.97 30.14 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 125.27 1.428 . . . . 0.0 113.392 179.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -134.23 -12.26 2.47 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 124.773 1.229 . . . . 0.0 114.058 178.071 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 38.3 m -139.13 6.89 2.4 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.08 1.352 . . . . 0.0 113.744 -173.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.9 p90 -158.65 176.01 12.92 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 126.042 1.737 . . . . 0.0 111.31 -176.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . 0.456 HH22 ' NE2' ' A' ' 500' ' ' GLN . 50.1 ttp85 -147.27 145.79 29.53 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.581 1.952 . . . . 0.0 110.098 174.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 69.5 mt -130.77 141.97 44.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.738 1.615 . . . . 0.0 109.629 178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . 0.456 ' NE2' HH22 ' A' ' 498' ' ' ARG . 24.0 pt20 -145.1 166.59 24.96 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.825 1.65 . . . . 0.0 110.924 171.124 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 52.0 p -71.72 163.24 28.15 Favored 'General case' 0 N--CA 1.479 0.99 0 O-C-N 120.756 -1.215 . . . . 0.0 112.378 174.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -58.69 -37.01 75.13 Favored 'General case' 0 CA--C 1.545 0.772 0 O-C-N 121.187 -0.946 . . . . 0.0 112.063 170.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.63 -40.71 95.95 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.333 -0.854 . . . . 0.0 112.809 174.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 51.8 mm-40 -65.35 -32.68 74.45 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.348 -0.845 . . . . 0.0 112.977 173.375 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 73.2 t80 -66.46 -50.85 61.93 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-N 119.119 0.872 . . . . 0.0 111.427 169.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 16.4 t -53.49 -44.08 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.064 0 C-N-CA 124.727 1.211 . . . . 0.0 112.046 177.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -67.87 -5.86 41.46 Favored Glycine 0 CA--C 1.539 1.592 0 C-N-CA 124.819 1.199 . . . . 0.0 115.596 179.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -115.23 -31.07 6.11 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.797 1.639 . . . . 0.0 112.314 173.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 15.1 tmtt? -60.2 -33.65 72.53 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 126.463 1.905 . . . . 0.0 112.639 169.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -134.35 133.31 40.5 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.628 1.571 . . . . 0.0 110.104 173.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -136.99 19.71 3.01 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 125.888 1.675 . . . . 0.0 113.044 -173.516 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -165.75 175.46 41.4 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.175 1.369 . . . . 0.0 113.607 -179.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -146.63 -35.2 0.27 Allowed 'General case' 0 N--CA 1.482 1.171 0 N-CA-C 114.558 1.318 . . . . 0.0 114.558 -173.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 37.7 tp60 -77.41 29.66 0.15 Allowed 'General case' 0 CA--C 1.554 1.097 0 C-N-CA 125.549 1.539 . . . . 0.0 114.151 -174.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 34.4 m -64.43 -20.45 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 O-C-N 120.395 -1.44 . . . . 0.0 114.241 -178.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . 0.404 ' HA ' ' HE2' ' A' ' 516' ' ' LYS . 0.4 OUTLIER -149.32 94.19 2.18 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.021 1.728 . . . . 0.0 110.394 177.468 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 65.1 m -62.32 161.61 11.21 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.26 1.024 . . . . 0.0 112.814 173.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -178.77 -167.16 36.0 Favored Glycine 0 CA--C 1.54 1.595 0 C-N-CA 124.977 1.275 . . . . 0.0 112.624 -176.919 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 56.4 Cg_endo -63.39 -19.42 68.08 Favored 'Trans proline' 0 CA--C 1.542 0.89 0 C-N-CA 123.343 2.695 . . . . 0.0 113.405 178.495 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 34.6 p -64.81 -8.98 17.26 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.884 1.674 . . . . 0.0 114.387 169.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 19.3 m -126.13 9.51 7.4 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 126.303 1.841 . . . . 0.0 113.271 179.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.25 0 CA-C-O 118.288 -1.284 . . . . 0.0 113.135 -179.281 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.425 -2.363 0 O5'-C5'-C4' 113.656 2.469 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.608 0 N-CA-C 112.017 -0.433 . . . . 0.0 112.017 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 23.2 t -153.55 -40.17 0.1 Allowed 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.474 1.11 . . . . 0.0 113.013 177.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 84.3 p -152.11 167.42 28.56 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.369 1.467 . . . . 0.0 112.196 178.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -167.33 24.26 0.12 Allowed Glycine 0 CA--C 1.537 1.449 0 N-CA-C 115.354 0.902 . . . . 0.0 115.354 -177.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 36.9 t -154.95 152.21 29.44 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 125.098 1.359 . . . . 0.0 111.599 -179.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 59.8 p -71.59 -22.57 61.71 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.901 1.28 . . . . 0.0 113.345 169.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 73.92 2.79 62.36 Favored Glycine 0 CA--C 1.541 1.681 0 C-N-CA 125.194 1.378 . . . . 0.0 115.522 -178.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 152.1 -168.37 31.32 Favored Glycine 0 CA--C 1.54 1.65 0 C-N-CA 125.164 1.364 . . . . 0.0 112.838 -175.655 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -64.78 -24.06 62.06 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 122.948 2.432 . . . . 0.0 112.532 169.663 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -151.04 -169.75 3.47 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 127.953 2.501 . . . . 0.0 108.861 168.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.3 pp -58.9 -3.94 0.4 Allowed 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 116.963 2.209 . . . . 0.0 116.963 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 9.0 tp-100 -131.74 117.42 16.31 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 127.019 2.128 . . . . 0.0 109.517 178.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -73.68 12.3 0.93 Allowed 'Trans proline' 0 CA--C 1.547 1.162 0 C-N-CA 124.494 3.463 . . . . 0.0 116.76 -171.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 29.8 mtpp -57.74 -6.14 0.48 Allowed 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 117.15 2.278 . . . . 0.0 117.15 -176.195 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 94.0 mtt180 -130.47 14.56 5.51 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.706 1.602 . . . . 0.0 113.874 169.728 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -67.64 -15.42 63.64 Favored 'General case' 0 CA--C 1.55 0.965 0 O-C-N 120.649 -1.282 . . . . 0.0 113.578 176.327 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 53.9 p-80 -88.19 8.0 29.17 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.401 1.881 . . . . 0.0 114.08 172.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 40.7 t -110.86 148.58 14.14 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 125.092 1.357 . . . . 0.0 110.903 -173.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 94.5 mt -122.69 164.24 18.63 Favored 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.186 2.594 . . . . 0.0 110.522 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 23.4 t-80 -126.75 139.12 53.37 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 126.461 1.905 . . . . 0.0 107.679 168.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.4 t -132.85 141.83 43.9 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 124.975 1.31 . . . . 0.0 109.226 -169.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.6 m -132.88 135.15 45.42 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 124.881 1.272 . . . . 0.0 109.753 -177.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -159.85 162.55 24.51 Favored Pre-proline 0 CA--C 1.547 0.843 0 C-N-CA 124.994 1.318 . . . . 0.0 111.719 -168.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -64.44 149.14 90.55 Favored 'Trans proline' 0 C--N 1.35 0.644 0 C-N-CA 122.215 1.943 . . . . 0.0 110.909 168.733 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -18.54 13.71 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 -177.745 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -57.34 -26.26 60.69 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 126.052 1.741 . . . . 0.0 113.979 173.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 19.7 m95 -64.65 154.4 36.56 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.001 0.921 . . . . 0.0 113.087 175.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 25.8 mtpt -132.17 164.99 25.1 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.597 1.959 . . . . 0.0 111.129 177.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.9 m -53.29 -34.75 58.61 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.743 1.217 . . . . 0.0 112.156 173.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.2 m -65.36 -43.35 91.11 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 113.734 1.012 . . . . 0.0 113.734 175.137 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 46.4 m-20 -64.81 -31.64 72.96 Favored 'General case' 0 N--CA 1.471 0.622 0 O-C-N 121.675 -0.64 . . . . 0.0 111.309 174.35 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.2 mt -71.05 -44.99 64.66 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.031 0.932 . . . . 0.0 111.551 175.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -57.22 -42.54 81.57 Favored 'General case' 0 CA--C 1.539 0.542 0 O-C-N 121.009 -1.057 . . . . 0.0 112.109 170.025 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -68.26 -29.07 67.79 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.458 1.103 . . . . 0.0 113.935 177.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.6 tp -69.5 -36.49 76.52 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.334 1.054 . . . . 0.0 112.316 173.547 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -110.96 -2.61 15.92 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -170.515 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 79.0 p -58.09 -19.66 33.8 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.881 1.437 . . . . 0.0 114.881 176.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -57.41 -18.93 20.36 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.084 1.354 . . . . 0.0 114.133 170.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -100.18 2.71 43.2 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.743 1.617 . . . . 0.0 113.612 178.266 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 96.27 -159.67 21.97 Favored Glycine 0 CA--C 1.534 1.256 0 C-N-CA 125.011 1.291 . . . . 0.0 111.891 -171.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 12.2 p30 -64.24 150.37 46.06 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 121.838 -0.801 . . . . 0.0 111.25 169.203 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 5.5 pt -143.53 179.76 1.47 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 125.338 1.455 . . . . 0.0 111.655 -174.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 55.4 mt-30 -128.15 151.9 48.66 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.537 1.535 . . . . 0.0 110.699 170.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 60.3 mt -139.4 134.35 39.74 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.919 1.688 . . . . 0.0 108.972 -172.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.9 m -139.35 102.2 4.43 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 124.991 1.316 . . . . 0.0 111.384 -177.45 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -59.28 153.15 19.28 Favored 'General case' 0 N--CA 1.47 0.558 0 N-CA-C 113.897 1.073 . . . . 0.0 113.897 177.673 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 29.5 pt -134.9 -23.93 0.61 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.625 0 C-N-CA 124.831 1.252 . . . . 0.0 113.416 169.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 33.0 t0 -153.7 174.38 14.59 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.353 1.061 . . . . 0.0 111.947 174.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.3 t70 -60.88 -15.09 26.82 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.601 1.96 . . . . 0.0 113.898 178.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 37.2 p -135.91 6.24 3.14 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 127.001 2.12 . . . . 0.0 113.448 -174.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 66.5 m -147.38 140.29 25.0 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.394 1.078 . . . . 0.0 113.218 -174.281 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.45 158.7 42.98 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.529 1.131 . . . . 0.0 112.49 177.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 68.3 m-85 -89.04 153.29 21.12 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 123.753 0.821 . . . . 0.0 110.006 167.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 73.4 t -136.3 140.53 43.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 124.92 1.288 . . . . 0.0 109.091 173.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 43.0 m -124.97 116.09 21.61 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 125.206 1.403 . . . . 0.0 110.083 -169.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 47.1 mt -102.94 166.32 10.52 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 125.202 1.401 . . . . 0.0 111.176 -175.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 50.8 m -69.84 -26.75 64.37 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 -175.279 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -148.22 148.85 30.54 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 124.497 1.119 . . . . 0.0 112.348 -177.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_exo -57.18 -26.02 67.37 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 123.5 2.8 . . . . 0.0 114.124 168.549 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -61.04 -33.54 73.46 Favored 'General case' 0 N--CA 1.472 0.671 0 O-C-N 121.064 -1.023 . . . . 0.0 112.56 172.25 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -76.46 -34.31 58.7 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 123.845 0.858 . . . . 0.0 111.799 174.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 22.4 t -57.54 -44.69 85.46 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 124.065 0.946 . . . . 0.0 111.354 170.292 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 48.9 tt0 -58.97 -41.04 86.58 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 123.133 0.573 . . . . 0.0 112.378 176.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 91.0 mt -66.87 -45.76 86.81 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 123.634 0.773 . . . . 0.0 110.938 175.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.1 -34.32 76.1 Favored 'General case' 0 CA--C 1.545 0.786 0 CA-C-N 119.324 0.965 . . . . 0.0 113.466 178.039 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 60.4 t -65.73 -43.84 93.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 O-C-N 121.296 -0.878 . . . . 0.0 111.003 170.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 58.6 t30 -60.5 -45.06 95.16 Favored 'General case' 0 CA--C 1.541 0.632 0 CA-C-N 118.922 0.783 . . . . 0.0 112.729 176.568 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 46.0 p -71.64 -27.4 63.06 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -177.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 24.8 p -63.21 -19.05 64.17 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.023 1.49 . . . . 0.0 115.023 178.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 59.1 mtmt -60.96 -18.38 56.95 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 125.254 1.422 . . . . 0.0 113.963 173.452 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 27.9 m-85 -119.06 1.4 11.41 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 125.064 1.345 . . . . 0.0 113.211 -171.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -68.19 152.78 44.96 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.669 1.188 . . . . 0.0 112.469 173.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -132.27 -4.9 3.41 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 124.818 1.247 . . . . 0.0 114.044 -177.564 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 22.6 m -136.52 5.9 2.96 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.322 1.449 . . . . 0.0 113.413 -177.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 48.7 p90 -161.04 171.52 18.47 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 127.039 2.135 . . . . 0.0 110.173 179.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 13.5 tpp180 -147.79 156.88 43.2 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 125.122 1.369 . . . . 0.0 111.06 169.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 69.3 mt -133.49 146.38 32.15 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 125.766 1.626 . . . . 0.0 109.572 -174.375 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 30.2 pt20 -142.11 161.78 37.15 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 125.98 1.712 . . . . 0.0 109.679 168.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 26.3 p -71.89 162.29 29.67 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 120.702 -1.249 . . . . 0.0 111.888 173.687 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -60.39 -33.41 72.44 Favored 'General case' 0 CA--C 1.543 0.707 0 O-C-N 121.161 -0.962 . . . . 0.0 111.953 169.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.91 -38.02 89.58 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 121.299 -0.875 . . . . 0.0 113.111 173.672 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -67.78 -39.67 84.07 Favored 'General case' 0 N--CA 1.472 0.643 0 O-C-N 121.09 -1.006 . . . . 0.0 112.144 172.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 62.0 t80 -62.23 -40.03 94.79 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.247 1.019 . . . . 0.0 112.288 174.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 12.5 t -64.72 -42.21 94.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.85 0 C-N-CA 125.279 1.432 . . . . 0.0 112.028 169.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -62.12 -36.73 93.37 Favored Glycine 0 CA--C 1.537 1.432 0 O-C-N 121.008 -1.058 . . . . 0.0 112.504 177.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 68.1 mttm -67.07 -35.48 79.92 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.359 1.064 . . . . 0.0 113.197 169.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 81.6 tttt -56.84 -42.36 79.54 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 124.474 1.11 . . . . 0.0 112.132 172.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 98.4 mt-30 -75.21 -12.24 60.25 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 125.16 1.384 . . . . 0.0 114.337 179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 67.7 mttm -136.59 30.51 2.87 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 126.008 1.723 . . . . 0.0 112.639 -171.741 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -173.32 -153.46 9.62 Favored Glycine 0 CA--C 1.533 1.178 0 C-N-CA 125.378 1.466 . . . . 0.0 112.623 -172.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -129.59 133.38 47.14 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.249 1.42 . . . . 0.0 111.375 177.229 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.4 tt0 -153.88 6.09 0.32 Allowed 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 124.64 1.176 . . . . 0.0 113.236 -170.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.6 m -58.99 -18.95 14.54 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.218 0 N-CA-C 115.773 1.768 . . . . 0.0 115.773 -169.201 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 27.2 tptp -67.52 -15.81 63.86 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 125.126 1.37 . . . . 0.0 113.831 173.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 49.2 m -130.39 148.77 52.24 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.962 1.305 . . . . 0.0 112.677 -171.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 163.04 -176.59 39.27 Favored Glycine 0 CA--C 1.541 1.706 0 C-N-CA 125.097 1.332 . . . . 0.0 113.147 -178.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -52.6 154.83 11.25 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 124.205 3.27 . . . . 0.0 114.001 172.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 65.4 p -60.29 -19.36 54.66 Favored 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 177.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 21.4 m -65.89 -17.46 64.67 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.504 1.522 . . . . 0.0 114.628 174.634 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.21 0 CA-C-O 118.322 -1.265 . . . . 0.0 113.349 -179.543 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.616 0 C5'-C4'-O4' 113.208 2.863 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.219 0 N-CA-C 110.61 -0.996 . . . . 0.0 110.61 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 48.9 m -140.73 -2.4 1.36 Allowed 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.609 1.563 . . . . 0.0 114.327 -179.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 67.8 m -138.14 170.8 15.4 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.809 1.244 . . . . 0.0 113.119 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 169.2 -22.86 0.1 OUTLIER Glycine 0 CA--C 1.538 1.483 0 N-CA-C 115.458 0.943 . . . . 0.0 115.458 177.881 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 60.1 p -71.88 -10.87 60.39 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 178.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 20.3 m -59.77 157.61 11.83 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 125.674 1.59 . . . . 0.0 113.75 178.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 77.54 -152.72 39.76 Favored Glycine 0 CA--C 1.537 1.436 0 C-N-CA 123.837 0.732 . . . . 0.0 113.55 179.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -155.83 172.99 33.88 Favored Glycine 0 CA--C 1.541 1.69 0 C-N-CA 124.932 1.254 . . . . 0.0 113.482 178.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -72.04 151.96 56.47 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.716 2.944 . . . . 0.0 113.431 -173.392 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 25.4 t0 -155.06 166.94 32.0 Favored 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 126.312 1.845 . . . . 0.0 110.44 173.242 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 91.0 mt -127.16 15.8 7.26 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 125.152 1.381 . . . . 0.0 114.32 -168.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 78.5 mt-30 -134.33 146.26 58.76 Favored Pre-proline 0 N--CA 1.476 0.857 0 C-N-CA 124.241 1.017 . . . . 0.0 112.859 -176.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -72.45 147.97 47.5 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 123.414 2.743 . . . . 0.0 111.654 173.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 36.8 mtmm -140.41 31.34 1.91 Allowed 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 125.608 1.563 . . . . 0.0 112.448 -170.783 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -133.65 112.49 11.47 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 125.226 1.41 . . . . 0.0 112.398 -174.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -156.13 -43.07 0.08 Allowed 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.816 2.046 . . . . 0.0 109.729 170.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 30.4 p-80 -70.26 38.19 0.05 OUTLIER 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 129.132 2.973 . . . . 0.0 112.941 168.396 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 46.3 t -128.07 126.11 65.71 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 125.005 1.322 . . . . 0.0 111.027 -168.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 83.8 mt -92.68 168.31 11.31 Favored 'General case' 0 CA--C 1.534 0.341 0 C-N-CA 126.423 1.889 . . . . 0.0 111.723 174.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 41.2 t-80 -128.19 136.23 50.81 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 127.43 2.292 . . . . 0.0 106.928 166.478 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 10.7 t -132.77 136.02 56.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.523 0 C-N-CA 124.602 1.161 . . . . 0.0 109.091 -171.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 16.5 m -124.82 135.51 53.0 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.109 1.364 . . . . 0.0 109.689 -178.876 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -156.2 156.51 30.39 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 124.487 1.115 . . . . 0.0 112.671 -169.165 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_exo -54.22 150.96 30.54 Favored 'Trans proline' 0 CA--C 1.537 0.651 0 C-N-CA 123.813 3.009 . . . . 0.0 112.644 168.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 23.2 pttm -56.18 -22.19 27.49 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 179.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -62.09 -27.66 69.07 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.456 1.503 . . . . 0.0 113.512 176.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -68.54 150.2 48.32 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.118 0.967 . . . . 0.0 112.968 -178.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 36.0 mttm -135.08 174.29 10.77 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.366 1.866 . . . . 0.0 112.145 176.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.4 m -48.36 -36.35 14.35 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.026 1.73 . . . . 0.0 112.713 173.869 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.8 m -64.63 -45.33 87.27 Favored 'General case' 0 N--CA 1.469 0.512 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 175.603 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 24.3 m-20 -63.49 -30.93 71.98 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.369 0.668 . . . . 0.0 111.416 175.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 73.6 mt -71.02 -46.62 61.82 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 123.821 0.849 . . . . 0.0 111.639 175.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 18.2 m-85 -61.95 -31.11 71.42 Favored 'General case' 0 N--CA 1.472 0.658 0 O-C-N 120.639 -1.288 . . . . 0.0 113.422 171.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -72.65 -34.65 67.41 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.442 1.097 . . . . 0.0 113.26 172.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 65.2 tp -64.5 -30.61 71.64 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 124.469 1.108 . . . . 0.0 112.253 172.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -115.64 22.95 12.72 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.95 1.3 . . . . 0.0 113.938 -175.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 92.1 p -59.12 -21.61 59.57 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 124.309 1.043 . . . . 0.0 113.796 172.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -61.73 -19.2 62.16 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.505 1.522 . . . . 0.0 114.047 169.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -115.05 -39.39 3.66 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.389 1.475 . . . . 0.0 111.483 176.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 65.36 7.98 35.49 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 125.707 1.622 . . . . 0.0 117.06 169.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -143.06 17.61 1.93 Allowed 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.194 1.398 . . . . 0.0 112.886 -170.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 19.5 pt -64.83 171.37 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 125.636 1.574 . . . . 0.0 113.577 -179.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 32.2 tt0 -134.55 144.05 47.75 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 125.301 1.441 . . . . 0.0 109.16 169.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 86.4 mt -121.63 133.97 66.42 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 124.154 0.982 . . . . 0.0 109.943 -169.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 71.2 m -134.82 97.03 3.66 Favored 'General case' 0 N--CA 1.465 0.285 0 C-N-CA 126.138 1.775 . . . . 0.0 109.938 -176.771 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.7 m95 -57.86 158.32 6.61 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.049 1.129 . . . . 0.0 114.049 -178.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 8.9 mt -132.89 -42.93 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.707 0 C-N-CA 124.974 1.309 . . . . 0.0 109.537 177.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 3.6 p-10 -155.16 -179.03 7.68 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.461 1.504 . . . . 0.0 111.85 173.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -59.61 -16.16 23.81 Favored 'General case' 0 CA--C 1.551 0.994 0 C-N-CA 125.805 1.642 . . . . 0.0 114.831 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 67.6 p -132.23 3.0 3.95 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 126.052 1.741 . . . . 0.0 114.577 -173.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 3.6 p -151.8 153.99 35.34 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 170.823 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -150.83 155.03 38.37 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.924 1.29 . . . . 0.0 112.353 -177.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -89.5 148.11 23.6 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 124.045 0.938 . . . . 0.0 109.517 167.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 56.4 t -138.61 111.24 6.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.956 0.902 . . . . 0.0 110.652 -178.259 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 74.0 m -77.42 139.43 39.68 Favored 'General case' 0 N--CA 1.467 0.408 0 C-N-CA 125.333 1.453 . . . . 0.0 111.44 174.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 52.1 mt -110.82 170.8 7.86 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.424 1.49 . . . . 0.0 111.625 179.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 61.9 m -77.97 -26.04 48.48 Favored 'General case' 0 N--CA 1.476 0.866 0 N-CA-C 113.432 0.901 . . . . 0.0 113.432 -178.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -144.93 148.74 40.04 Favored Pre-proline 0 CA--C 1.544 0.734 0 C-N-CA 125.144 1.378 . . . . 0.0 111.207 178.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -55.1 -29.56 66.29 Favored 'Trans proline' 0 C--N 1.351 0.692 0 C-N-CA 123.682 2.921 . . . . 0.0 114.551 171.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -59.89 -36.16 76.37 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.524 1.13 . . . . 0.0 113.1 177.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 98.0 mt-30 -67.28 -20.9 65.71 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.458 1.103 . . . . 0.0 113.252 -178.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 96.9 t -60.42 -44.43 96.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 124.241 1.016 . . . . 0.0 111.01 176.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 4.5 mp0 -68.03 -35.42 78.24 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.721 0.808 . . . . 0.0 111.497 178.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 68.2 mt -61.79 -48.29 89.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 C-N-CA 123.813 0.845 . . . . 0.0 110.453 176.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.88 -35.8 82.31 Favored 'General case' 0 CA--C 1.544 0.744 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 178.475 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 72.0 t -65.9 -41.43 89.96 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.932 0 O-C-N 121.134 -0.979 . . . . 0.0 111.209 171.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 66.5 t30 -62.43 -32.31 73.14 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.148 0.979 . . . . 0.0 113.271 176.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 39.4 p -86.24 -27.52 24.4 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.019 0.928 . . . . 0.0 113.086 178.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 11.2 t -69.58 -24.05 63.63 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.425 1.268 . . . . 0.0 114.425 178.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -60.67 -19.31 58.11 Favored 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 -177.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 54.5 m-85 -90.16 -10.34 44.89 Favored 'General case' 0 CA--C 1.545 0.763 0 C-N-CA 125.305 1.442 . . . . 0.0 114.066 176.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -68.92 152.53 45.16 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.204 1.002 . . . . 0.0 113.535 -173.508 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -140.61 2.93 1.85 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.222 1.409 . . . . 0.0 113.864 175.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 77.4 p -135.84 1.07 2.74 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 126.271 1.828 . . . . 0.0 113.742 -177.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 48.4 p90 -156.34 175.04 14.53 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.425 2.29 . . . . 0.0 109.591 173.413 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 46.3 ttm180 -147.04 146.84 30.15 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 125.031 1.332 . . . . 0.0 110.984 175.444 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 48.3 mt -129.27 139.48 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 125.972 1.709 . . . . 0.0 109.055 175.347 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -147.57 171.27 15.84 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 126.449 1.9 . . . . 0.0 109.829 173.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 19.0 p -72.86 164.01 27.26 Favored 'General case' 0 N--CA 1.481 1.111 0 O-C-N 120.334 -1.479 . . . . 0.0 112.319 172.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 33.1 t80 -52.85 -44.6 66.88 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.523 0.729 . . . . 0.0 111.518 168.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -69.14 -35.25 76.17 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 113.446 0.906 . . . . 0.0 113.446 -178.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -63.58 -43.72 96.15 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 119.168 0.895 . . . . 0.0 111.965 173.471 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -58.92 -50.82 72.61 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.005 0.522 . . . . 0.0 111.773 174.208 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 45.8 t -57.61 -50.69 76.51 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 124.111 0.965 . . . . 0.0 111.692 176.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -61.92 -38.61 96.3 Favored Glycine 0 CA--C 1.532 1.112 0 C-N-CA 123.482 0.563 . . . . 0.0 113.457 -175.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -66.97 -51.36 56.14 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.079 0.952 . . . . 0.0 111.745 171.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -58.27 -39.35 78.99 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.844 1.658 . . . . 0.0 113.547 -177.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 89.7 mm-40 -75.56 -6.76 51.91 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.691 1.367 . . . . 0.0 114.691 179.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -123.9 -9.93 7.74 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 115.646 1.721 . . . . 0.0 115.646 -173.271 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 167.45 176.88 38.58 Favored Glycine 0 CA--C 1.532 1.137 0 CA-C-N 120.01 1.277 . . . . 0.0 116.107 169.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.2 161.51 6.96 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.927 1.291 . . . . 0.0 112.742 170.845 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 96.5 mm-40 -114.65 7.96 16.13 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.653 1.181 . . . . 0.0 113.116 -173.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 53.0 t -62.75 143.35 15.56 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.538 1.535 . . . . 0.0 110.775 172.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 16.2 tppt? -146.46 -45.77 0.19 Allowed 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 124.639 1.176 . . . . 0.0 112.82 176.425 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 30.9 m -67.99 167.05 14.58 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.963 1.305 . . . . 0.0 112.959 172.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -163.82 -178.34 37.34 Favored Glycine 0 CA--C 1.539 1.558 0 C-N-CA 124.466 1.031 . . . . 0.0 113.366 175.432 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 76.9 Cg_exo -52.4 -29.29 38.67 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 124.248 3.299 . . . . 0.0 115.467 -179.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 19.3 m -75.42 -15.19 60.47 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 114.676 1.361 . . . . 0.0 114.676 178.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 65.3 m -66.35 152.66 44.55 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 124.043 0.937 . . . . 0.0 112.948 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.261 0 C-N-CA 125.198 1.38 . . . . 0.0 112.764 178.674 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.725 0 C5'-C4'-O4' 113.697 3.212 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.571 0 N-CA-C 111.439 -0.664 . . . . 0.0 111.439 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 62.9 p -153.5 165.21 36.58 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.223 1.409 . . . . 0.0 112.566 -178.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 48.9 p -66.87 162.79 20.92 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 125.073 1.349 . . . . 0.0 113.137 173.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 166.6 -27.79 0.17 Allowed Glycine 0 CA--C 1.534 1.248 0 N-CA-C 115.346 0.898 . . . . 0.0 115.346 175.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 9.7 t -149.03 151.25 34.18 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 125.127 1.371 . . . . 0.0 111.149 176.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 45.9 p -71.2 157.16 38.62 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 124.337 1.055 . . . . 0.0 113.277 178.084 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -178.6 -23.45 0.03 OUTLIER Glycine 0 CA--C 1.537 1.414 0 N-CA-C 116.069 1.188 . . . . 0.0 116.069 174.145 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 147.02 -61.69 0.46 Allowed Glycine 0 CA--C 1.537 1.449 0 CA-C-N 118.59 1.195 . . . . 0.0 112.578 177.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -56.45 -27.77 70.02 Favored 'Trans proline' 0 CA--C 1.54 0.813 0 C-N-CA 124.046 3.164 . . . . 0.0 113.188 169.081 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 23.6 t0 -142.73 156.28 44.99 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.764 2.026 . . . . 0.0 109.847 169.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 95.9 mt -141.8 26.5 1.89 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 126.703 2.001 . . . . 0.0 111.436 -173.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 37.0 mt-30 -125.43 74.01 68.33 Favored Pre-proline 0 CA--C 1.548 0.878 0 C-N-CA 125.671 1.589 . . . . 0.0 111.379 -168.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -69.62 161.19 46.89 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.113 2.542 . . . . 0.0 112.928 -177.638 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -63.89 11.31 0.04 OUTLIER 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 126.295 1.838 . . . . 0.0 115.371 172.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 4.9 mmp_? -125.09 6.86 7.9 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 127.655 2.382 . . . . 0.0 112.875 176.391 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -60.37 -25.96 66.27 Favored 'General case' 0 CA--C 1.549 0.919 0 O-C-N 120.801 -1.187 . . . . 0.0 113.791 178.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 53.3 p-80 -92.82 18.94 8.17 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.484 1.914 . . . . 0.0 113.737 176.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 24.6 t -125.85 147.44 30.61 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.892 0 C-N-CA 124.773 1.229 . . . . 0.0 111.98 -169.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 74.3 mt -118.45 164.08 15.79 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.568 2.347 . . . . 0.0 110.849 179.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -122.87 139.2 54.28 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 126.783 2.033 . . . . 0.0 107.772 168.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.0 t -131.34 142.11 44.19 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 124.855 1.262 . . . . 0.0 109.345 -169.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.54 136.16 50.38 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 125.458 1.503 . . . . 0.0 109.581 -178.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.3 p90 -160.08 157.88 25.69 Favored Pre-proline 0 CA--C 1.548 0.884 0 C-N-CA 123.598 0.759 . . . . 0.0 112.963 -170.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -55.65 145.75 68.86 Favored 'Trans proline' 0 CA--C 1.539 0.735 0 C-N-CA 123.757 2.971 . . . . 0.0 112.499 168.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -55.69 -24.59 35.27 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 -176.329 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -67.1 -17.63 64.96 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.985 1.314 . . . . 0.0 114.162 177.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 14.2 m95 -62.63 155.08 27.16 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.094 0.958 . . . . 0.0 112.979 173.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 51.8 mttp -139.53 165.79 26.29 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 126.528 1.931 . . . . 0.0 110.674 -173.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 5.7 m -57.03 -32.48 66.22 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.115 0.966 . . . . 0.0 111.763 176.046 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 43.6 m -66.58 -42.03 87.61 Favored 'General case' 0 N--CA 1.472 0.635 0 N-CA-C 113.733 1.012 . . . . 0.0 113.733 173.331 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -65.79 -31.71 72.83 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 121.438 -0.789 . . . . 0.0 111.248 174.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.4 mt -70.68 -44.92 66.0 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.861 0.864 . . . . 0.0 111.501 174.262 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 21.6 m-85 -57.51 -38.2 74.26 Favored 'General case' 0 N--CA 1.471 0.578 0 O-C-N 121.091 -1.006 . . . . 0.0 112.407 169.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 25.0 tp60 -68.29 -40.36 81.8 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 118.98 0.809 . . . . 0.0 112.999 175.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.0 tp -64.32 -36.02 82.76 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 124.842 1.257 . . . . 0.0 112.273 179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -106.84 10.42 30.68 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.569 1.148 . . . . 0.0 113.419 -176.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 22.2 t -55.81 -31.74 62.93 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 125.664 1.586 . . . . 0.0 113.791 179.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.84 -15.23 11.5 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 125.443 1.497 . . . . 0.0 115.021 178.068 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -101.63 -0.52 34.6 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.888 1.275 . . . . 0.0 114.11 -176.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 77.31 -41.73 1.85 Allowed Glycine 0 CA--C 1.536 1.399 0 C-N-CA 126.086 1.803 . . . . 0.0 116.101 169.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 19.3 t30 -148.59 130.81 15.5 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.282 1.433 . . . . 0.0 110.673 178.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 18.7 pt -145.92 174.73 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.805 0 C-N-CA 125.435 1.494 . . . . 0.0 111.478 -172.351 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -138.88 146.82 41.62 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.813 1.245 . . . . 0.0 109.001 168.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 67.9 mt -127.78 130.07 70.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 125.032 1.333 . . . . 0.0 109.222 -174.019 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 51.8 m -136.85 94.74 3.01 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 125.195 1.398 . . . . 0.0 111.022 -176.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -55.83 154.33 7.27 Favored 'General case' 0 N--CA 1.47 0.54 0 C-N-CA 124.701 1.2 . . . . 0.0 113.633 176.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 17.7 pt -132.27 -28.97 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 C-N-CA 124.474 1.109 . . . . 0.0 113.617 170.61 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -160.15 -175.16 4.91 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.917 1.287 . . . . 0.0 112.44 172.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -57.89 -22.0 46.17 Favored 'General case' 0 CA--C 1.545 0.761 0 N-CA-C 115.555 1.687 . . . . 0.0 115.555 -177.197 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.6 p -134.2 5.33 3.53 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.938 1.295 . . . . 0.0 113.979 -171.123 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 60.9 m -143.56 147.92 35.16 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.705 1.202 . . . . 0.0 113.295 176.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.26 156.23 39.29 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.299 1.44 . . . . 0.0 111.753 175.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -89.9 151.57 21.67 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 123.557 0.743 . . . . 0.0 110.18 168.115 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.5 t -137.98 115.9 12.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.496 1.118 . . . . 0.0 110.325 176.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 16.3 m -83.62 140.64 32.08 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 125.074 1.35 . . . . 0.0 110.673 172.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 80.4 mt -123.18 147.04 47.28 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 124.769 1.227 . . . . 0.0 110.2 176.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 5.2 m -65.8 -16.01 63.41 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 115.767 1.766 . . . . 0.0 115.767 -172.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -140.25 148.09 52.75 Favored Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 124.562 1.145 . . . . 0.0 111.429 175.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 71.1 Cg_endo -70.0 -20.75 33.29 Favored 'Trans proline' 0 CA--C 1.54 0.823 0 C-N-CA 123.105 2.537 . . . . 0.0 113.579 179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -66.59 -32.61 74.06 Favored 'General case' 0 N--CA 1.475 0.79 0 O-C-N 120.825 -1.172 . . . . 0.0 112.346 172.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -67.29 -31.2 71.35 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 124.163 0.985 . . . . 0.0 112.189 178.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.2 t -58.64 -46.42 90.29 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.933 0 C-N-CA 125.242 1.417 . . . . 0.0 110.741 173.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -63.86 -41.92 97.66 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 123.501 0.72 . . . . 0.0 112.031 176.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 94.6 mt -63.1 -42.55 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.579 0.752 . . . . 0.0 111.292 177.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.41 -39.72 95.26 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.114 -0.991 . . . . 0.0 113.094 176.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 69.2 t -66.16 -42.02 90.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 O-C-N 121.218 -0.926 . . . . 0.0 111.347 172.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.9 t30 -61.22 -37.66 83.84 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.121 0.968 . . . . 0.0 113.116 176.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 22.0 p -83.32 -28.87 28.74 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.556 1.142 . . . . 0.0 113.237 -178.101 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 8.7 t -60.78 -19.38 59.23 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.95 1.093 . . . . 0.0 113.95 171.235 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -51.77 -26.54 9.84 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 125.703 1.601 . . . . 0.0 113.661 169.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 37.4 m-85 -114.9 10.15 16.31 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 125.606 1.562 . . . . 0.0 113.093 -174.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -64.71 156.56 29.97 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 124.931 1.293 . . . . 0.0 113.095 176.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.55 -5.46 1.21 Allowed 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 114.88 1.437 . . . . 0.0 114.88 176.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 51.0 m -137.31 5.08 2.71 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.392 1.477 . . . . 0.0 113.629 -178.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 49.5 p90 -157.92 176.07 13.02 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 126.241 1.816 . . . . 0.0 111.208 -177.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 69.5 ttt-85 -147.34 145.21 29.24 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 127.003 2.121 . . . . 0.0 109.997 177.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 79.2 mt -132.5 141.61 44.73 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 125.434 1.494 . . . . 0.0 109.841 178.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 27.9 pt20 -143.12 163.82 31.81 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 126.109 1.764 . . . . 0.0 110.509 169.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 65.1 p -73.02 161.51 30.59 Favored 'General case' 0 N--CA 1.478 0.945 0 O-C-N 120.753 -1.217 . . . . 0.0 112.347 174.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 45.7 t80 -60.42 -34.15 73.54 Favored 'General case' 0 CA--C 1.545 0.759 0 O-C-N 121.206 -0.934 . . . . 0.0 111.591 168.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -63.88 -37.82 88.81 Favored 'General case' 0 CA--C 1.546 0.799 0 O-C-N 121.447 -0.783 . . . . 0.0 113.09 174.308 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -66.52 -42.36 87.41 Favored 'General case' 0 N--CA 1.471 0.599 0 O-C-N 121.13 -0.982 . . . . 0.0 112.168 170.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -56.74 -47.99 78.8 Favored 'General case' 0 CA--C 1.541 0.622 0 CA-C-N 118.777 0.717 . . . . 0.0 111.422 173.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 22.7 t -58.91 -44.18 90.22 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 125.038 1.335 . . . . 0.0 112.288 173.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -62.8 -37.57 95.08 Favored Glycine 0 CA--C 1.536 1.385 0 O-C-N 121.604 -0.685 . . . . 0.0 113.09 -179.477 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 14.3 mptt -71.33 -32.0 68.05 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.638 1.175 . . . . 0.0 113.019 169.443 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 18.6 tptp -65.44 -40.22 93.03 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 125.373 1.469 . . . . 0.0 112.976 176.602 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 56.4 mm-40 -62.45 110.7 1.75 Allowed 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 125.262 1.425 . . . . 0.0 111.931 177.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 27.8 ttmt -148.08 19.15 1.11 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.899 1.28 . . . . 0.0 113.676 -175.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -166.56 36.69 0.24 Allowed Glycine 0 CA--C 1.534 1.28 0 C-N-CA 124.13 0.872 . . . . 0.0 114.854 -173.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -62.23 -21.74 65.4 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.893 1.677 . . . . 0.0 114.994 -173.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -73.58 25.48 0.07 Allowed 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 126.662 1.985 . . . . 0.0 115.659 -171.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.4 m -63.54 -14.32 14.43 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.308 0 N-CA-C 115.373 1.62 . . . . 0.0 115.373 -179.469 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 96.4 mttt -75.88 46.87 0.4 Allowed 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 127.013 2.125 . . . . 0.0 113.589 -175.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 97.4 p -143.35 172.78 12.3 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.775 1.63 . . . . 0.0 112.882 -173.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 60.54 -148.48 44.5 Favored Glycine 0 CA--C 1.543 1.817 0 C-N-CA 123.877 0.751 . . . . 0.0 113.335 179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_endo -71.32 3.12 3.76 Favored 'Trans proline' 0 CA--C 1.548 1.214 0 C-N-CA 123.718 2.945 . . . . 0.0 114.193 177.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 40.9 m -120.25 12.55 11.8 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.071 1.749 . . . . 0.0 113.25 -174.114 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 83.9 p -65.82 -19.36 65.85 Favored 'General case' 0 N--CA 1.476 0.836 0 N-CA-C 114.975 1.472 . . . . 0.0 114.975 178.142 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.205 0 C-N-CA 125.53 1.538 . . . . 0.0 112.649 178.713 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.71 0 O5'-C5'-C4' 114.033 2.738 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.54 0 N-CA-C 112.054 -0.419 . . . . 0.0 112.054 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 23.1 m -137.13 9.71 3.0 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.932 1.293 . . . . 0.0 113.888 -172.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 60.2 p -71.9 -12.62 61.35 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -179.074 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -178.52 -172.85 43.33 Favored Glycine 0 CA--C 1.535 1.335 0 C-N-CA 124.86 1.219 . . . . 0.0 113.62 -178.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 78.8 p -134.86 11.94 3.65 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 125.648 1.579 . . . . 0.0 113.936 -174.391 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 89.8 p -145.76 170.44 16.52 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 126.107 1.763 . . . . 0.0 112.264 -178.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -161.18 36.64 0.41 Allowed Glycine 0 CA--C 1.535 1.327 0 C-N-CA 124.069 0.842 . . . . 0.0 114.484 -173.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -153.77 58.56 0.4 Allowed Glycine 0 CA--C 1.539 1.582 0 C-N-CA 124.772 1.177 . . . . 0.0 114.083 -179.133 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 68.2 Cg_endo -75.86 -2.5 12.68 Favored 'Trans proline' 0 CA--C 1.545 1.061 0 C-N-CA 124.129 3.219 . . . . 0.0 114.794 -175.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -139.98 150.67 44.75 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 125.184 1.394 . . . . 0.0 112.411 -173.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 84.6 mt -78.84 58.67 2.4 Favored 'General case' 0 CA--C 1.548 0.886 0 C-N-CA 126.632 1.973 . . . . 0.0 112.59 -176.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 42.3 tt0 -52.52 130.99 45.02 Favored Pre-proline 0 CA--C 1.554 1.101 0 C-N-CA 125.302 1.441 . . . . 0.0 112.091 179.174 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 80.0 Cg_endo -74.12 164.86 33.34 Favored 'Trans proline' 0 CA--C 1.541 0.848 0 C-N-CA 123.282 2.655 . . . . 0.0 113.661 -176.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -146.91 165.13 30.7 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 127.772 2.429 . . . . 0.0 109.65 176.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 91.2 mtm-85 -129.0 23.62 5.67 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 125.489 1.515 . . . . 0.0 113.917 -175.072 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -63.35 -22.8 67.1 Favored 'General case' 0 CA--C 1.55 0.962 0 O-C-N 121.087 -1.008 . . . . 0.0 113.543 176.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.6 p-80 -90.32 15.36 10.66 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 126.757 2.023 . . . . 0.0 113.93 175.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 42.5 t -117.59 141.78 34.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.929 1.292 . . . . 0.0 111.182 -173.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 93.7 mt -108.16 163.58 13.05 Favored 'General case' 0 C--N 1.332 -0.18 0 C-N-CA 126.819 2.048 . . . . 0.0 111.489 176.234 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 32.7 t-80 -122.53 136.19 54.83 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 126.699 2.0 . . . . 0.0 107.026 166.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 4.8 t -132.27 138.59 52.01 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.519 0 C-N-CA 124.893 1.277 . . . . 0.0 109.088 -169.383 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.2 m -129.55 136.17 49.49 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.924 1.29 . . . . 0.0 109.529 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.1 p90 -158.85 155.96 25.8 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.404 1.082 . . . . 0.0 112.538 -169.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -56.13 144.85 78.86 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.5 2.8 . . . . 0.0 111.418 167.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 7.2 ptpt -59.59 -19.14 46.72 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 115.094 1.516 . . . . 0.0 115.094 -176.774 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -63.43 -21.77 66.49 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.696 1.598 . . . . 0.0 114.016 172.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -63.36 150.94 42.21 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 119.002 0.819 . . . . 0.0 112.276 172.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 55.8 mtmt -130.73 169.1 16.14 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 126.329 1.852 . . . . 0.0 111.634 178.681 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.5 m -50.92 -34.46 28.63 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.652 1.181 . . . . 0.0 112.513 171.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 43.2 m -66.19 -40.18 90.24 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 113.638 0.977 . . . . 0.0 113.638 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -66.82 -31.97 72.93 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 121.608 -0.683 . . . . 0.0 111.168 173.427 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 90.8 mt -70.56 -41.38 72.52 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.615 0.766 . . . . 0.0 111.485 174.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 28.3 m-85 -60.55 -42.22 96.12 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 120.959 -1.088 . . . . 0.0 111.634 169.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.3 tt0 -60.78 -33.91 73.68 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.122 -0.986 . . . . 0.0 112.681 175.114 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 44.9 tp -79.49 -27.23 41.48 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.849 1.26 . . . . 0.0 114.105 178.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -128.76 -17.5 4.02 Favored 'General case' 0 N--CA 1.478 0.958 0 N-CA-C 116.888 2.181 . . . . 0.0 116.888 -168.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 14.8 t -60.87 -21.8 63.63 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 120.63 1.559 . . . . 0.0 113.43 179.422 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -54.36 -24.32 19.01 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 125.413 1.485 . . . . 0.0 114.521 171.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 55.9 m-85 -80.46 -1.23 40.75 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.307 1.225 . . . . 0.0 114.307 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 99.77 -44.67 1.61 Allowed Glycine 0 CA--C 1.533 1.197 0 C-N-CA 125.705 1.622 . . . . 0.0 114.541 168.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 45.4 t30 -152.69 136.91 16.54 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 125.12 1.368 . . . . 0.0 110.391 175.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 29.1 pt -144.42 171.79 6.42 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 C-N-CA 124.679 1.191 . . . . 0.0 112.298 -174.094 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 33.7 tt0 -143.89 145.82 32.57 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 125.133 1.373 . . . . 0.0 109.146 169.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 77.0 mt -127.15 128.71 70.67 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.752 1.221 . . . . 0.0 109.158 -172.462 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 46.3 m -136.18 99.38 4.11 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 125.455 1.502 . . . . 0.0 111.071 -176.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 80.2 m95 -58.42 151.1 20.74 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.196 0.998 . . . . 0.0 113.63 178.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 38.2 pt -133.59 -19.84 0.87 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.582 0 C-N-CA 124.778 1.231 . . . . 0.0 113.278 169.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.4 t0 -152.0 178.19 9.69 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.743 1.217 . . . . 0.0 111.713 172.826 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -66.17 -14.66 62.21 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 126.158 1.783 . . . . 0.0 112.926 174.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.0 p -134.64 5.03 3.39 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 126.598 1.959 . . . . 0.0 113.718 -172.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 88.0 p -155.05 154.9 33.16 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 173.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.39 161.5 42.25 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.663 1.585 . . . . 0.0 112.088 -177.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 58.2 m-85 -93.48 149.66 21.06 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 123.982 0.913 . . . . 0.0 110.054 167.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 61.2 t -138.3 114.91 10.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 124.174 0.99 . . . . 0.0 110.746 177.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 19.3 m -77.61 141.21 39.61 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.835 1.254 . . . . 0.0 111.066 172.544 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 70.7 mt -121.08 165.62 15.07 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.42 1.488 . . . . 0.0 110.621 171.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 55.0 m -63.67 -29.66 70.86 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 114.215 1.191 . . . . 0.0 114.215 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 91.1 mt-30 -146.47 152.4 45.71 Favored Pre-proline 0 CA--C 1.545 0.781 0 C-N-CA 124.628 1.171 . . . . 0.0 112.385 -176.703 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -69.37 -17.23 39.45 Favored 'Trans proline' 0 CA--C 1.543 0.944 0 C-N-CA 123.329 2.686 . . . . 0.0 113.497 172.093 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 12.7 mp0 -63.23 -35.61 80.9 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 120.616 -1.303 . . . . 0.0 111.539 169.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.6 mt-30 -74.96 -30.57 61.25 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 124.125 0.97 . . . . 0.0 112.356 177.612 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 13.5 t -57.02 -44.96 83.7 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.862 0 C-N-CA 124.008 0.923 . . . . 0.0 111.173 171.014 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 31.2 tt0 -60.81 -41.27 95.34 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 123.107 0.563 . . . . 0.0 112.272 176.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 98.8 mt -61.43 -50.64 79.55 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.806 0.842 . . . . 0.0 110.668 176.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.87 -36.54 83.64 Favored 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 113.676 0.991 . . . . 0.0 113.676 -179.275 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 78.3 t -65.75 -41.16 89.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.773 0 O-C-N 121.117 -0.989 . . . . 0.0 111.242 171.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -63.2 -43.84 97.05 Favored 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 118.795 0.725 . . . . 0.0 112.832 176.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 35.3 p -68.86 -27.82 66.16 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 123.708 0.803 . . . . 0.0 113.068 -178.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.3 t -65.53 -18.24 65.18 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 114.396 1.258 . . . . 0.0 114.396 174.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 61.5 mtpt -60.29 -14.32 17.52 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 124.702 1.201 . . . . 0.0 114.043 176.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -128.95 13.29 6.27 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 126.076 1.75 . . . . 0.0 112.609 -176.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.05 159.21 23.69 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.997 1.319 . . . . 0.0 113.044 175.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -138.06 -0.99 2.01 Favored 'General case' 0 N--CA 1.48 1.035 0 N-CA-C 114.806 1.41 . . . . 0.0 114.806 -178.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 8.7 t -145.03 4.74 1.1 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.218 1.407 . . . . 0.0 113.006 -178.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.0 p90 -159.27 174.85 14.16 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.378 1.471 . . . . 0.0 111.637 -177.484 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 79.2 ttt-85 -145.01 147.82 33.05 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 126.386 1.874 . . . . 0.0 110.313 169.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 68.4 mt -129.1 141.45 46.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.669 0 C-N-CA 126.336 1.855 . . . . 0.0 109.611 179.038 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -144.52 166.07 26.2 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 125.932 1.693 . . . . 0.0 109.728 169.031 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 25.7 p -71.79 162.28 29.68 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 120.696 -1.252 . . . . 0.0 111.677 175.15 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 93.6 t80 -57.09 -39.19 74.52 Favored 'General case' 0 CA--C 1.543 0.711 0 O-C-N 121.278 -0.889 . . . . 0.0 111.829 168.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.76 -36.97 86.02 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 113.319 0.859 . . . . 0.0 113.319 176.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 18.2 mm-40 -67.33 -40.96 85.95 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 121.171 -0.956 . . . . 0.0 112.145 173.368 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 71.3 t80 -59.55 -49.11 79.03 Favored 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 118.42 0.555 . . . . 0.0 111.476 172.605 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 21.0 t -56.72 -45.23 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 C-N-CA 124.647 1.179 . . . . 0.0 111.924 174.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -63.3 -40.56 99.12 Favored Glycine 0 CA--C 1.535 1.311 0 C-N-CA 123.714 0.673 . . . . 0.0 113.287 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -68.76 -28.09 66.48 Favored 'General case' 0 N--CA 1.478 0.965 0 CA-C-N 118.169 0.985 . . . . 0.0 113.546 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 61.3 tttm -74.69 -17.19 60.71 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.724 1.61 . . . . 0.0 114.143 179.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -59.71 151.77 24.3 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 124.288 1.035 . . . . 0.0 112.869 175.365 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -145.53 20.55 1.51 Allowed 'General case' 0 N--CA 1.483 1.183 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 -173.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -88.01 152.22 23.58 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 124.044 0.83 . . . . 0.0 113.688 179.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 59.2 tttp -158.62 150.81 21.53 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 126.271 1.828 . . . . 0.0 110.258 178.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 64.5 tt0 -56.31 -36.67 68.96 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 114.178 1.177 . . . . 0.0 114.178 -176.181 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 7.1 p -63.96 -20.68 27.15 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 125.558 1.543 . . . . 0.0 113.707 178.156 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 57.3 mtpt -89.77 -0.45 57.56 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 125.816 1.647 . . . . 0.0 112.93 178.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 22.5 m 65.39 -31.76 0.14 Allowed 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 129.3 3.04 . . . . 0.0 117.588 174.366 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 169.16 52.98 0.03 OUTLIER Glycine 0 CA--C 1.537 1.444 0 CA-C-N 119.747 1.158 . . . . 0.0 115.246 178.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -67.73 -28.98 36.45 Favored 'Trans proline' 0 CA--C 1.542 0.885 0 C-N-CA 122.802 2.335 . . . . 0.0 113.065 -177.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 18.2 m -72.52 -13.41 61.41 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 125.214 1.405 . . . . 0.0 114.243 -179.733 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 44.5 m -72.03 -11.17 60.64 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 114.939 1.459 . . . . 0.0 114.939 -175.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.199 0 C-N-CA 124.969 1.271 . . . . 0.0 113.044 178.93 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . 0.5 ' H81' " O4'" ' A' ' 524' ' ' GDP . . . . . . . . 0 O4'--C4' 1.418 -2.927 0 C5'-C4'-O4' 113.169 2.835 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . 0.5 " O4'" ' H81' ' A' ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.575 0 N-CA-C 112.249 -0.341 . . . . 0.0 112.249 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 50.5 m -135.67 6.34 3.2 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 125.081 1.352 . . . . 0.0 113.817 -171.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 15.0 m -78.46 35.42 0.23 Allowed 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 127.071 2.148 . . . . 0.0 114.791 -169.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -169.09 -149.06 6.04 Favored Glycine 0 CA--C 1.531 1.067 0 C-N-CA 125.348 1.451 . . . . 0.0 112.01 -175.237 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 31.8 p -59.83 -15.13 18.55 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 113.958 1.095 . . . . 0.0 113.958 169.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 19.3 p -69.23 -11.77 61.09 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.399 2.279 . . . . 0.0 115.941 178.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -170.47 -179.45 41.89 Favored Glycine 0 CA--C 1.534 1.258 0 CA-C-N 119.882 1.219 . . . . 0.0 114.977 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 167.21 -158.19 31.0 Favored Glycine 0 CA--C 1.539 1.545 0 C-N-CA 124.186 0.898 . . . . 0.0 113.011 -174.363 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.73 -19.55 10.92 Favored 'Trans proline' 0 CA--C 1.543 0.966 0 C-N-CA 124.717 3.611 . . . . 0.0 115.551 170.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 18.3 m-20 -135.02 155.74 50.25 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.407 1.883 . . . . 0.0 110.524 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.2 pp -69.22 -5.98 26.13 Favored 'General case' 0 CA--C 1.546 0.796 0 N-CA-C 116.111 1.893 . . . . 0.0 116.111 -173.699 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -146.99 81.0 9.21 Favored Pre-proline 0 CA--C 1.549 0.925 0 C-N-CA 126.771 2.028 . . . . 0.0 109.244 178.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -57.34 152.39 46.69 Favored 'Trans proline' 0 CA--C 1.54 0.783 0 C-N-CA 123.418 2.745 . . . . 0.0 113.795 177.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.27 -14.91 2.93 Favored 'General case' 0 N--CA 1.482 1.149 0 N-CA-C 115.457 1.651 . . . . 0.0 115.457 173.786 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 73.4 mtt180 28.95 52.04 0.07 Allowed 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 129.798 3.239 . . . . 0.0 116.077 170.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -63.29 -15.57 57.64 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.687 1.366 . . . . 0.0 114.687 -177.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 36.2 p-80 -96.27 13.79 26.36 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 126.909 2.084 . . . . 0.0 113.695 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 55.4 t -128.0 143.5 40.66 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.915 1.286 . . . . 0.0 111.777 -171.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 72.1 mt -107.16 166.3 10.73 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 127.342 2.257 . . . . 0.0 111.496 175.697 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 22.8 t-80 -121.53 137.55 54.68 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 126.974 2.11 . . . . 0.0 107.103 166.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 13.4 t -133.81 139.72 48.02 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.522 0 C-N-CA 124.877 1.271 . . . . 0.0 108.958 -169.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 8.0 m -128.72 132.52 47.99 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.193 1.397 . . . . 0.0 109.252 -178.176 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -151.49 159.71 32.93 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 124.444 1.098 . . . . 0.0 112.895 -168.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_exo -52.15 150.15 19.96 Favored 'Trans proline' 0 CA--C 1.538 0.706 0 C-N-CA 124.19 3.26 . . . . 0.0 114.058 170.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.0 pttm -53.67 -28.05 31.1 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 125.456 1.503 . . . . 0.0 115.048 178.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -81.55 -12.91 58.63 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 125.406 1.483 . . . . 0.0 114.212 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 7.6 m0 -65.63 152.8 43.31 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 119.305 0.957 . . . . 0.0 112.982 177.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -129.72 168.93 15.76 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.403 1.881 . . . . 0.0 111.832 -178.861 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 2.2 m -48.53 -35.45 13.29 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 125.444 1.498 . . . . 0.0 112.213 169.35 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 70.8 m -64.41 -43.72 93.5 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 175.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -64.54 -33.18 75.32 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.751 -0.593 . . . . 0.0 111.147 174.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.92 -44.57 65.91 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.87 0.868 . . . . 0.0 111.792 176.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.38 -43.42 92.91 Favored 'General case' 0 N--CA 1.468 0.457 0 O-C-N 121.166 -0.959 . . . . 0.0 112.018 169.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -61.43 -32.21 72.17 Favored 'General case' 0 CA--C 1.543 0.688 0 CA-C-N 118.923 0.783 . . . . 0.0 112.977 175.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 52.7 tp -74.83 -34.3 62.31 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.499 1.12 . . . . 0.0 113.254 177.668 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 80.6 m-85 -116.53 -5.88 11.69 Favored 'General case' 0 N--CA 1.476 0.84 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -169.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 87.1 p -57.62 -22.88 48.0 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 114.549 1.315 . . . . 0.0 114.549 175.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.4 -21.62 51.21 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.063 1.345 . . . . 0.0 114.17 173.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -94.24 -5.89 45.86 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 125.157 1.383 . . . . 0.0 113.779 177.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 109.69 -154.07 16.68 Favored Glycine 0 CA--C 1.534 1.235 0 C-N-CA 125.071 1.319 . . . . 0.0 112.213 -173.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -61.37 153.61 26.34 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 123.652 0.781 . . . . 0.0 112.13 169.46 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 33.0 pt -142.54 176.92 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 125.389 1.476 . . . . 0.0 111.795 -175.553 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -143.82 146.16 32.87 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 125.2 1.4 . . . . 0.0 108.926 169.03 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 77.8 mt -129.48 133.28 65.56 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.793 0 C-N-CA 124.679 1.192 . . . . 0.0 109.289 -172.402 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 39.5 m -134.78 97.38 3.76 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 125.742 1.617 . . . . 0.0 110.497 -178.272 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 81.9 m95 -60.01 153.29 21.79 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 124.731 1.212 . . . . 0.0 113.955 -178.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 28.9 pt -133.44 -24.47 0.7 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.597 0 C-N-CA 124.817 1.247 . . . . 0.0 112.9 169.501 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 24.1 m-20 -149.75 173.18 14.0 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.748 1.619 . . . . 0.0 112.064 173.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -58.81 -20.48 50.6 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 125.557 1.543 . . . . 0.0 113.66 169.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.4 p -126.58 0.93 6.86 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.046 1.738 . . . . 0.0 114.197 -172.09 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 36.3 p -154.4 151.26 28.8 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 114.42 1.267 . . . . 0.0 114.42 174.28 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.87 160.58 43.08 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 125.617 1.567 . . . . 0.0 111.96 -176.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -89.13 149.76 23.02 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.448 0.699 . . . . 0.0 110.341 167.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 48.5 t -138.53 119.15 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.976 0 C-N-CA 124.564 1.146 . . . . 0.0 110.773 178.228 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 14.1 t -80.99 144.52 31.75 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 125.191 1.396 . . . . 0.0 111.881 176.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 86.0 mt -129.66 155.6 45.61 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.737 1.615 . . . . 0.0 110.871 174.364 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 48.9 m -68.85 -24.17 64.33 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 115.061 1.504 . . . . 0.0 115.061 -169.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 -137.99 151.45 70.12 Favored Pre-proline 0 CA--C 1.546 0.812 0 C-N-CA 124.75 1.22 . . . . 0.0 111.527 172.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 64.9 Cg_endo -67.97 -18.63 46.42 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.262 2.641 . . . . 0.0 113.744 174.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 39.8 tt0 -64.17 -37.93 89.24 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.662 -1.274 . . . . 0.0 111.98 170.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 91.6 mt-30 -67.3 -32.94 74.26 Favored 'General case' 0 CA--C 1.539 0.55 0 O-C-N 121.405 -0.81 . . . . 0.0 112.092 177.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 58.8 t -58.93 -47.28 90.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 C-N-CA 124.79 1.236 . . . . 0.0 110.506 172.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 50.6 tt0 -62.48 -42.87 99.79 Favored 'General case' 0 CA--C 1.54 0.586 0 O-C-N 121.571 -0.706 . . . . 0.0 112.211 176.252 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 87.4 mt -62.76 -43.81 99.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 123.76 0.824 . . . . 0.0 111.368 177.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.1 -38.56 91.68 Favored 'General case' 0 CA--C 1.542 0.644 0 O-C-N 121.324 -0.86 . . . . 0.0 113.069 177.157 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 71.1 t -66.76 -42.47 89.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 O-C-N 121.283 -0.886 . . . . 0.0 111.364 173.002 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 57.3 t30 -60.79 -44.44 96.8 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 119.032 0.833 . . . . 0.0 112.661 176.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 26.1 p -74.69 -21.74 59.23 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.224 1.009 . . . . 0.0 113.649 -178.008 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 21.2 p -65.2 -15.17 62.17 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 114.892 1.442 . . . . 0.0 114.892 175.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 60.4 mtpt -56.41 -15.14 3.64 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 125.671 1.588 . . . . 0.0 114.122 172.285 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 20.8 m-85 -126.93 16.04 7.38 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 126.286 1.834 . . . . 0.0 112.333 -174.528 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.51 -36.75 84.77 Favored 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -174.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 52.68 -18.65 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 129.751 3.22 . . . . 0.0 118.906 -175.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 50.2 m -135.48 1.36 2.86 Favored 'General case' 0 N--CA 1.483 1.198 0 C-N-CA 125.226 1.411 . . . . 0.0 114.371 -173.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -155.58 176.14 12.99 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 127.183 2.193 . . . . 0.0 109.56 177.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 38.4 ttm180 -144.6 150.26 37.15 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.289 1.036 . . . . 0.0 111.767 178.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 78.2 mt -135.66 144.11 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 126.083 1.753 . . . . 0.0 109.5 -177.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -147.54 168.63 21.47 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.148 1.779 . . . . 0.0 110.376 169.535 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 18.6 p -71.65 163.59 27.48 Favored 'General case' 0 N--CA 1.48 1.039 0 O-C-N 120.659 -1.276 . . . . 0.0 111.702 172.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 86.5 t80 -55.35 -42.06 73.35 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.272 -0.892 . . . . 0.0 112.308 169.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.47 -40.25 92.94 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 123.653 0.781 . . . . 0.0 112.868 177.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -67.45 -31.9 72.4 Favored 'General case' 0 CA--C 1.539 0.557 0 O-C-N 121.442 -0.786 . . . . 0.0 112.66 175.359 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 39.4 t80 -67.24 -49.98 62.4 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 119.063 0.847 . . . . 0.0 111.415 169.016 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 8.6 t -53.64 -42.03 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 C-N-CA 124.502 1.121 . . . . 0.0 111.795 178.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -68.71 -9.97 60.01 Favored Glycine 0 CA--C 1.54 1.634 0 N-CA-C 115.468 0.947 . . . . 0.0 115.468 178.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 51.4 mttp -114.02 -15.77 12.25 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.805 1.642 . . . . 0.0 113.971 176.129 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 40.7 tttp -46.37 -36.54 6.51 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 126.62 1.968 . . . . 0.0 115.063 -170.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 16.1 mm100 -66.75 -20.79 66.03 Favored 'General case' 0 CA--C 1.546 0.821 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 -177.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -147.62 -18.76 0.37 Allowed 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 115.844 1.794 . . . . 0.0 115.844 -172.585 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -57.67 -23.94 51.52 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 126.136 1.826 . . . . 0.0 116.902 -169.835 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -141.27 156.62 45.85 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.134 1.373 . . . . 0.0 111.234 169.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 93.1 mm-40 -132.61 21.22 4.27 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 125.099 1.36 . . . . 0.0 113.054 -168.475 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 13.7 p -143.44 147.26 20.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 C-N-CA 125.207 1.403 . . . . 0.0 111.309 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -140.94 -21.09 0.79 Allowed 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 125.574 1.55 . . . . 0.0 114.152 -174.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 45.9 m -145.81 166.43 25.96 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 125.66 1.584 . . . . 0.0 111.848 -175.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -170.1 176.67 43.75 Favored Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.668 1.128 . . . . 0.0 113.494 178.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -72.29 -10.86 26.24 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 124.118 3.212 . . . . 0.0 114.539 -174.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 57.4 p -60.61 -15.85 32.39 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 125.489 1.516 . . . . 0.0 114.962 178.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 83.3 p -69.09 -17.01 63.81 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 114.697 1.369 . . . . 0.0 114.697 173.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.266 0 CA-C-O 118.308 -1.273 . . . . 0.0 113.423 179.669 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.417 -3.03 0 C5'-C4'-O4' 112.891 2.637 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.559 0 N-CA-C 111.883 -0.487 . . . . 0.0 111.883 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 82.5 p -140.41 10.57 2.3 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -174.107 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 17.4 m 57.37 23.47 8.99 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.991 1.717 . . . . 0.0 115.038 -179.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -164.22 172.25 39.98 Favored Glycine 0 CA--C 1.532 1.123 0 C-N-CA 124.998 1.285 . . . . 0.0 113.222 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 20.4 m -57.79 -19.36 27.76 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.434 1.642 . . . . 0.0 115.434 -170.303 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 19.7 m -65.77 -19.41 65.88 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 125.182 1.393 . . . . 0.0 114.488 175.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -179.95 5.95 0.02 OUTLIER Glycine 0 CA--C 1.538 1.52 0 N-CA-C 118.263 2.065 . . . . 0.0 118.263 -177.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 177.26 61.38 0.06 OUTLIER Glycine 0 CA--C 1.537 1.408 0 CA-C-N 120.175 1.987 . . . . 0.0 114.748 176.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 97.1 Cg_endo -70.52 168.11 23.49 Favored 'Trans proline' 0 CA--C 1.541 0.845 0 C-N-CA 123.474 2.783 . . . . 0.0 113.163 -179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -144.23 138.65 28.17 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.145 1.378 . . . . 0.0 110.337 169.255 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -148.88 17.11 0.98 Allowed 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 126.114 1.766 . . . . 0.0 113.278 -173.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -53.82 147.2 24.19 Favored Pre-proline 0 CA--C 1.55 0.965 0 C-N-CA 124.873 1.269 . . . . 0.0 113.614 -179.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.37 164.17 36.62 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 123.233 2.622 . . . . 0.0 112.612 178.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 58.9 mtpt -127.31 16.4 7.15 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.743 1.617 . . . . 0.0 112.864 -178.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 82.6 mtt85 51.38 21.17 1.12 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 128.291 2.636 . . . . 0.0 115.696 -175.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -66.91 -17.01 64.7 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.246 1.419 . . . . 0.0 113.234 169.563 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 32.2 p-80 -95.2 14.67 21.42 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 126.899 2.08 . . . . 0.0 113.386 175.52 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 39.8 t -122.19 142.9 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.875 0 C-N-CA 124.856 1.263 . . . . 0.0 111.583 -170.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 76.5 mt -114.12 164.35 13.97 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 127.328 2.251 . . . . 0.0 110.868 177.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -120.95 140.24 52.14 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 126.875 2.07 . . . . 0.0 107.772 168.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.5 t -133.62 142.79 40.64 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.381 0 C-N-CA 124.776 1.23 . . . . 0.0 109.15 -169.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 12.2 m -132.27 134.05 44.82 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 125.215 1.406 . . . . 0.0 109.581 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.0 p90 -158.55 157.32 28.6 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 124.293 1.037 . . . . 0.0 112.561 -169.495 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -55.83 144.17 78.24 Favored 'Trans proline' 0 CA--C 1.538 0.703 0 C-N-CA 123.53 2.82 . . . . 0.0 112.179 168.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 25.9 pttm -55.2 -24.27 26.3 Favored 'General case' 0 N--CA 1.482 1.128 0 N-CA-C 114.924 1.453 . . . . 0.0 114.924 -178.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -64.44 -13.96 54.32 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.247 1.419 . . . . 0.0 114.554 177.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 12.5 m95 -68.99 156.0 39.37 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.5 1.12 . . . . 0.0 112.877 172.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.8 mptt -129.16 170.11 13.95 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 126.381 1.872 . . . . 0.0 111.058 174.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.1 m -51.81 -33.53 36.12 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 124.788 1.235 . . . . 0.0 111.943 169.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 68.3 m -64.83 -42.3 95.07 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 114.059 1.133 . . . . 0.0 114.059 175.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 32.2 m-20 -66.31 -31.8 72.81 Favored 'General case' 0 N--CA 1.472 0.667 0 O-C-N 121.626 -0.671 . . . . 0.0 111.094 174.116 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.2 mt -70.98 -43.02 68.92 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 123.78 0.832 . . . . 0.0 111.395 174.966 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 18.8 m-85 -57.47 -44.1 84.6 Favored 'General case' 0 N--CA 1.469 0.522 0 O-C-N 120.926 -1.109 . . . . 0.0 111.511 169.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.0 tt0 -62.45 -33.51 74.96 Favored 'General case' 0 CA--C 1.547 0.845 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 50.7 tp -73.93 -29.72 62.18 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.444 1.098 . . . . 0.0 113.412 177.41 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -120.38 -4.39 9.9 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 115.947 1.832 . . . . 0.0 115.947 -169.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 86.5 p -59.42 -20.24 53.46 Favored 'General case' 0 N--CA 1.48 1.057 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 173.405 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -60.77 -9.19 3.68 Favored 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.923 1.689 . . . . 0.0 114.87 172.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 28.4 m-85 -119.28 14.97 13.05 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.745 1.618 . . . . 0.0 113.398 -172.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 89.31 -149.41 20.67 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.484 1.04 . . . . 0.0 112.704 179.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -62.58 142.55 57.95 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 123.482 0.713 . . . . 0.0 111.281 170.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 38.5 pt -142.57 174.16 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.489 1.515 . . . . 0.0 111.698 -176.755 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 31.0 tt0 -138.79 142.37 38.74 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.897 1.279 . . . . 0.0 109.044 168.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 69.8 mt -122.33 124.89 71.96 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 C-N-CA 125.067 1.347 . . . . 0.0 108.471 -176.633 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 75.7 m -135.25 94.83 3.18 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.416 1.486 . . . . 0.0 110.904 -169.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 86.7 m95 -56.27 152.72 10.6 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.325 1.05 . . . . 0.0 113.648 178.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 27.4 pt -129.88 -22.59 1.27 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 124.707 1.203 . . . . 0.0 113.206 170.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -162.43 -174.12 3.88 Favored 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 126.713 2.005 . . . . 0.0 110.233 169.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 6.5 p-10 -74.08 -5.32 40.91 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 116.005 1.854 . . . . 0.0 116.005 -176.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 69.5 p -135.44 2.15 2.95 Favored 'General case' 0 N--CA 1.481 1.104 0 CA-C-N 119.757 1.162 . . . . 0.0 114.064 -177.246 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 45.5 m -144.51 150.57 37.79 Favored 'General case' 0 N--CA 1.467 0.383 0 C-N-CA 125.411 1.485 . . . . 0.0 113.295 173.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.6 156.89 41.37 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 125.195 1.398 . . . . 0.0 111.588 177.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 49.4 m-85 -89.87 151.1 21.92 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.492 0.717 . . . . 0.0 109.874 167.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 63.1 t -138.34 114.53 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 124.137 0.975 . . . . 0.0 110.536 176.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 32.5 m -79.32 138.93 37.9 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.687 1.195 . . . . 0.0 110.533 171.195 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 56.1 mt -113.81 164.49 13.67 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.526 1.13 . . . . 0.0 111.703 175.752 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 22.7 t -55.49 -40.96 72.37 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.478 1.111 . . . . 0.0 113.452 -175.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 30.8 mm-40 -146.51 160.86 40.48 Favored Pre-proline 0 CA--C 1.547 0.848 0 C-N-CA 126.324 1.85 . . . . 0.0 110.982 175.458 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -70.88 -12.45 30.79 Favored 'Trans proline' 0 CA--C 1.538 0.717 0 C-N-CA 123.334 2.689 . . . . 0.0 114.074 -178.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 46.3 mt-10 -61.53 -38.91 89.15 Favored 'General case' 0 N--CA 1.473 0.713 0 O-C-N 120.983 -1.073 . . . . 0.0 112.445 173.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 27.9 mp0 -76.54 -20.4 56.91 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.069 0.948 . . . . 0.0 113.309 -178.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 75.3 t -58.42 -44.58 89.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 124.653 1.181 . . . . 0.0 110.59 173.513 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -61.91 -40.47 95.58 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 123.698 0.799 . . . . 0.0 112.183 174.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 57.0 mt -65.12 -45.7 93.34 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 123.482 0.713 . . . . 0.0 110.843 179.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.5 -36.0 82.33 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.381 0.882 . . . . 0.0 113.381 177.705 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 79.0 t -65.52 -40.93 89.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 O-C-N 120.987 -1.07 . . . . 0.0 110.992 170.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.4 t30 -63.13 -39.96 96.19 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 123.847 0.859 . . . . 0.0 113.156 176.111 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 44.2 p -76.68 -31.05 57.01 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 123.798 0.839 . . . . 0.0 112.842 -178.798 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.2 t -61.17 -19.58 61.74 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.243 1.201 . . . . 0.0 114.243 173.393 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 84.1 tttt -54.16 -22.63 11.75 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 125.539 1.535 . . . . 0.0 113.54 169.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -122.73 10.38 9.63 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.903 1.681 . . . . 0.0 113.144 -175.3 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -66.45 157.33 32.29 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.513 1.125 . . . . 0.0 112.83 175.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.43 -5.1 1.24 Allowed 'General case' 0 N--CA 1.478 0.974 0 N-CA-C 115.159 1.54 . . . . 0.0 115.159 -179.592 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 50.6 m -135.55 4.47 3.11 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 125.347 1.459 . . . . 0.0 113.468 -178.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.9 p90 -161.59 175.18 12.35 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 127.096 2.158 . . . . 0.0 110.213 -177.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 54.9 ttt85 -147.44 151.75 36.95 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 125.442 1.497 . . . . 0.0 111.17 169.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 49.3 mt -132.46 142.29 42.99 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.705 0 C-N-CA 126.019 1.727 . . . . 0.0 110.091 -175.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 28.7 pt20 -145.34 171.43 14.61 Favored 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 126.304 1.841 . . . . 0.0 110.137 169.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 44.7 p -72.18 160.85 31.75 Favored 'General case' 0 N--CA 1.48 1.036 0 O-C-N 120.481 -1.387 . . . . 0.0 112.325 174.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 75.4 t80 -55.29 -43.01 74.37 Favored 'General case' 0 CA--C 1.542 0.664 0 O-C-N 121.5 -0.75 . . . . 0.0 111.565 168.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.75 -38.05 89.68 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 123.888 0.875 . . . . 0.0 113.31 179.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 34.5 mm-40 -62.04 -45.54 93.12 Favored 'General case' 0 N--CA 1.471 0.582 0 O-C-N 121.424 -0.798 . . . . 0.0 112.072 173.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 89.2 t80 -61.36 -48.6 80.54 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.51 0.595 . . . . 0.0 111.817 174.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 18.0 t -54.03 -41.59 50.81 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.944 0 C-N-CA 124.342 1.057 . . . . 0.0 112.18 175.786 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -70.24 -12.78 69.53 Favored Glycine 0 CA--C 1.54 1.599 0 N-CA-C 115.424 0.93 . . . . 0.0 115.424 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -127.35 -1.45 6.3 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 178.349 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -20.82 84.57 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 131.266 3.826 . . . . 0.0 115.688 -174.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -61.77 -16.68 51.68 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.561 1.544 . . . . 0.0 114.351 -174.377 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 64.3 mttp -75.15 -9.79 58.87 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.344 1.458 . . . . 0.0 114.566 174.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -120.98 127.55 7.04 Favored Glycine 0 CA--C 1.532 1.096 0 C-N-CA 124.505 1.05 . . . . 0.0 113.391 -175.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -58.31 -25.88 62.39 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 125.629 1.572 . . . . 0.0 113.7 179.494 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.6 mp0 -71.57 -8.22 52.61 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 126.158 1.783 . . . . 0.0 113.977 178.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 1.1 t -130.09 14.96 2.31 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 125.409 1.484 . . . . 0.0 112.166 -169.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -149.2 160.31 43.48 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 125.509 1.523 . . . . 0.0 113.008 -176.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 50.0 m -76.77 163.13 27.1 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 124.721 1.208 . . . . 0.0 112.482 172.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -177.53 172.51 45.26 Favored Glycine 0 CA--C 1.541 1.693 0 C-N-CA 124.219 0.914 . . . . 0.0 114.103 173.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -55.71 155.29 22.54 Favored 'Trans proline' 0 CA--C 1.539 0.76 0 C-N-CA 124.373 3.382 . . . . 0.0 114.714 177.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 50.1 m -60.69 110.22 1.24 Allowed 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.833 1.253 . . . . 0.0 111.342 172.023 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 64.6 p -146.76 7.29 0.95 Allowed 'General case' 0 N--CA 1.479 0.976 0 N-CA-C 114.633 1.346 . . . . 0.0 114.633 -170.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.183 0 C-N-CA 125.425 1.488 . . . . 0.0 112.963 178.53 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.423 -2.52 0 C5'-C4'-O4' 113.19 2.85 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.469 0 N-CA-C 111.886 -0.486 . . . . 0.0 111.886 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 78.0 p -136.67 -2.45 2.16 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 114.754 1.39 . . . . 0.0 114.754 -175.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 87.4 p -155.8 165.03 37.72 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.682 1.593 . . . . 0.0 111.931 176.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 172.23 174.22 39.47 Favored Glycine 0 CA--C 1.535 1.295 0 C-N-CA 124.468 1.032 . . . . 0.0 113.776 177.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 88.3 p -156.92 168.42 27.53 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 125.452 1.501 . . . . 0.0 112.294 178.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 37.3 m -133.94 10.19 3.9 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 125.237 1.415 . . . . 0.0 113.301 -177.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 169.76 -171.64 43.38 Favored Glycine 0 CA--C 1.535 1.339 0 C-N-CA 125.755 1.645 . . . . 0.0 112.595 -176.416 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -167.8 171.93 42.42 Favored Glycine 0 CA--C 1.539 1.587 0 C-N-CA 124.053 0.835 . . . . 0.0 114.004 175.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_exo -53.05 132.9 49.9 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 124.588 3.525 . . . . 0.0 114.635 -178.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -143.73 4.55 1.33 Allowed 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.683 1.364 . . . . 0.0 114.683 173.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . 0.476 HD23 ' H ' ' A' ' 433' ' ' LEU . 2.5 pt? -64.16 176.57 0.98 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 126.284 1.834 . . . . 0.0 113.61 169.711 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 31.3 mm-40 -134.42 146.11 58.01 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.871 1.668 . . . . 0.0 110.003 169.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -72.06 126.65 12.02 Favored 'Trans proline' 0 CA--C 1.54 0.777 0 C-N-CA 122.99 2.46 . . . . 0.0 112.809 -171.714 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 20.7 pttm -154.81 176.35 12.59 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 126.818 2.047 . . . . 0.0 110.743 170.635 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 86.9 mmt-85 -135.97 -6.76 2.11 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 115.339 1.607 . . . . 0.0 115.339 -174.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -67.35 -2.72 6.56 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 115.042 1.497 . . . . 0.0 115.042 177.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 37.2 p-80 -117.3 12.86 14.45 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 126.322 1.849 . . . . 0.0 113.06 175.041 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 45.2 t -116.43 125.81 73.62 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.9 0 C-N-CA 124.635 1.174 . . . . 0.0 111.849 -169.672 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 82.2 mt -93.72 167.97 11.31 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.91 1.684 . . . . 0.0 111.693 169.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 36.1 t-80 -128.13 136.68 51.48 Favored 'General case' 0 C--N 1.326 -0.417 0 C-N-CA 127.052 2.141 . . . . 0.0 106.806 166.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 11.6 t -132.98 136.86 54.87 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.55 0 C-N-CA 124.606 1.163 . . . . 0.0 109.131 -169.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 19.0 m -125.89 134.1 51.7 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 125.055 1.342 . . . . 0.0 109.423 -176.421 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.9 p90 -156.78 156.98 30.58 Favored Pre-proline 0 CA--C 1.548 0.892 0 C-N-CA 124.362 1.065 . . . . 0.0 112.462 -168.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.24 145.22 67.18 Favored 'Trans proline' 0 CA--C 1.538 0.688 0 C-N-CA 123.548 2.832 . . . . 0.0 112.193 168.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -55.71 -22.96 26.17 Favored 'General case' 0 N--CA 1.481 1.109 0 N-CA-C 115.362 1.615 . . . . 0.0 115.362 -178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -67.71 -12.86 61.42 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.398 1.479 . . . . 0.0 114.329 177.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.8 m95 -70.34 156.31 39.48 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.371 1.068 . . . . 0.0 113.115 173.267 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.5 mptt -131.82 170.23 15.13 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.387 1.875 . . . . 0.0 111.727 174.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.3 m -48.17 -37.84 16.63 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 126.199 1.8 . . . . 0.0 111.857 169.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 67.7 m -62.31 -45.25 94.07 Favored 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 113.77 1.026 . . . . 0.0 113.77 175.358 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 31.5 m-20 -64.56 -30.7 71.73 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.264 0.626 . . . . 0.0 111.529 175.463 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 77.1 mt -72.82 -46.45 53.05 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.853 0.861 . . . . 0.0 111.867 177.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 15.8 m-85 -61.82 -31.9 72.17 Favored 'General case' 0 N--CA 1.472 0.652 0 O-C-N 120.774 -1.204 . . . . 0.0 112.809 170.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -69.9 -35.82 74.92 Favored 'General case' 0 CA--C 1.544 0.748 0 CA-C-N 119.095 0.862 . . . . 0.0 112.787 172.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 58.3 tp -65.1 -32.74 74.6 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 124.754 1.222 . . . . 0.0 112.251 175.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -114.02 13.41 18.19 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 114.899 1.444 . . . . 0.0 114.899 -174.032 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 90.6 p -56.91 -26.37 59.01 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.333 1.234 . . . . 0.0 114.333 178.938 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.48 -21.96 60.87 Favored 'General case' 0 CA--C 1.548 0.868 0 C-N-CA 125.312 1.445 . . . . 0.0 114.466 174.657 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 22.4 m-85 -92.98 -2.44 55.75 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.785 1.234 . . . . 0.0 113.703 177.008 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 78.84 -45.21 2.68 Favored Glycine 0 CA--C 1.536 1.363 0 C-N-CA 125.911 1.72 . . . . 0.0 114.248 178.23 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 24.8 m120 -145.54 151.31 37.94 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.649 1.58 . . . . 0.0 111.416 178.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 19.9 pt -149.36 178.94 0.66 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 127.28 2.232 . . . . 0.0 110.258 173.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 43.3 tt0 -141.96 144.61 33.8 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 125.152 1.381 . . . . 0.0 109.007 167.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 66.0 mt -123.79 137.55 56.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.912 0 C-N-CA 123.897 0.879 . . . . 0.0 110.585 -169.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 69.5 m -135.17 95.28 3.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 126.184 1.794 . . . . 0.0 109.932 178.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 90.4 m95 -58.86 152.25 19.74 Favored 'General case' 0 N--CA 1.469 0.484 0 C-N-CA 123.996 0.919 . . . . 0.0 113.233 178.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 39.2 pt -134.74 -20.94 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.596 0 C-N-CA 124.679 1.192 . . . . 0.0 113.524 172.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -153.32 175.6 12.92 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.649 1.179 . . . . 0.0 111.686 173.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -64.8 -13.34 55.21 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 125.803 1.641 . . . . 0.0 113.569 174.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 42.0 p -133.97 3.16 3.44 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 125.684 1.594 . . . . 0.0 113.928 -174.067 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 51.8 p -154.86 157.24 37.54 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 114.878 1.436 . . . . 0.0 114.878 171.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.29 157.2 39.77 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 125.542 1.537 . . . . 0.0 111.831 -175.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 47.2 m-85 -89.83 149.26 22.75 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 123.457 0.703 . . . . 0.0 110.176 167.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 42.6 t -138.17 111.12 7.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.775 0 C-N-CA 124.135 0.974 . . . . 0.0 110.57 -179.485 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 58.5 m -75.81 139.05 41.56 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 125.355 1.462 . . . . 0.0 111.059 171.206 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 45.7 mt -113.15 159.7 18.99 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.178 1.391 . . . . 0.0 111.436 177.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 68.3 m -67.17 -26.38 66.61 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -178.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 32.2 mm-40 -143.09 147.11 39.68 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 124.876 1.271 . . . . 0.0 111.889 176.161 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.1 -33.13 82.64 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 123.896 3.064 . . . . 0.0 114.716 173.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -61.9 -29.5 70.25 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 121.178 -0.951 . . . . 0.0 113.175 178.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 96.5 mt-30 -68.69 -24.68 64.53 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.155 0.982 . . . . 0.0 112.51 178.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 66.4 t -62.37 -43.24 97.94 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 124.233 1.013 . . . . 0.0 110.539 175.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 77.4 mt-30 -63.44 -39.51 94.66 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.654 0.782 . . . . 0.0 111.894 177.142 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 82.6 mt -63.79 -47.39 91.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 C-N-CA 123.913 0.885 . . . . 0.0 110.645 176.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.24 -39.86 94.81 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 113.047 0.758 . . . . 0.0 113.047 178.729 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 55.1 t -63.62 -43.08 98.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.466 0.706 . . . . 0.0 111.324 173.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 51.5 t30 -62.98 -46.76 86.16 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.022 0.828 . . . . 0.0 112.678 175.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 29.9 p -74.33 -20.3 60.15 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 114.067 1.136 . . . . 0.0 114.067 -175.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 25.5 p -57.8 -24.81 59.06 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.175 1.176 . . . . 0.0 114.175 173.694 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 37.3 ttpt -56.49 -20.45 20.26 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.694 1.998 . . . . 0.0 114.016 174.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -109.36 4.79 22.93 Favored 'General case' 0 CA--C 1.546 0.798 0 C-N-CA 125.312 1.445 . . . . 0.0 113.689 -174.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -64.9 159.69 22.2 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.03 0.932 . . . . 0.0 113.136 176.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -138.43 -2.46 1.79 Allowed 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 125.009 1.324 . . . . 0.0 114.051 174.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 76.1 p -148.64 5.95 0.71 Allowed 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.172 1.389 . . . . 0.0 114.364 -172.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -158.99 173.25 16.79 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 126.479 1.912 . . . . 0.0 110.741 -178.753 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -140.83 154.98 46.45 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 126.171 1.788 . . . . 0.0 110.982 169.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 62.0 mt -135.93 142.68 38.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 C-N-CA 125.952 1.701 . . . . 0.0 109.058 -179.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -149.96 173.68 13.54 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 126.222 1.809 . . . . 0.0 110.661 172.593 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 37.6 p -74.65 163.36 27.81 Favored 'General case' 0 N--CA 1.478 0.971 0 O-C-N 120.713 -1.242 . . . . 0.0 112.248 172.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -55.86 -42.02 75.25 Favored 'General case' 0 CA--C 1.545 0.766 0 O-C-N 121.285 -0.885 . . . . 0.0 112.053 169.25 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.57 -38.63 91.67 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 124.113 0.965 . . . . 0.0 113.27 178.61 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -62.79 -43.67 98.18 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.437 -0.789 . . . . 0.0 112.133 172.843 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -60.96 -48.06 83.54 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 118.699 0.681 . . . . 0.0 111.985 175.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 9.3 t -52.37 -37.7 23.98 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 C-N-CA 124.487 1.115 . . . . 0.0 113.023 178.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -78.06 -46.56 9.19 Favored Glycine 0 CA--C 1.536 1.397 0 O-C-N 121.796 -0.565 . . . . 0.0 113.257 177.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -73.34 -24.32 60.35 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 114.244 1.202 . . . . 0.0 114.244 -176.754 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 8.0 tmtm? -58.66 -30.78 67.59 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.499 1.92 . . . . 0.0 113.504 175.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -71.62 100.56 2.32 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 125.532 1.533 . . . . 0.0 110.958 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -140.4 161.96 36.45 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 125.895 1.678 . . . . 0.0 112.496 -172.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -144.29 3.4 1.43 Allowed Glycine 0 CA--C 1.538 1.497 0 C-N-CA 125.538 1.542 . . . . 0.0 114.982 174.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 51.7 tptt -116.15 -9.82 11.59 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 125.86 1.664 . . . . 0.0 113.886 -171.418 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 -128.98 16.82 6.23 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 126.073 1.749 . . . . 0.0 112.382 -177.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 36.0 m -129.51 2.04 2.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.153 0 C-N-CA 125.515 1.526 . . . . 0.0 114.048 -169.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 54.9 mttp -76.15 -2.63 32.01 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.071 1.349 . . . . 0.0 114.327 176.736 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 87.6 p -141.26 172.68 12.34 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 125.886 1.674 . . . . 0.0 112.718 -175.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -147.23 66.73 0.4 Allowed Glycine 0 CA--C 1.537 1.412 0 C-N-CA 125.23 1.395 . . . . 0.0 112.802 -175.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.42 -16.97 34.85 Favored 'Trans proline' 0 CA--C 1.544 0.998 0 C-N-CA 123.707 2.938 . . . . 0.0 114.367 -175.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 77.5 p -141.85 2.2 1.54 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 125.226 1.41 . . . . 0.0 114.439 -175.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 85.5 p -155.79 164.62 38.31 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 125.51 1.524 . . . . 0.0 112.313 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.257 0 C-N-CA 125.041 1.305 . . . . 0.0 112.852 -179.808 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.42 -2.726 0 C5'-C4'-O4' 111.923 1.945 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.656 0 N-CA-C 112.048 -0.421 . . . . 0.0 112.048 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 77.4 p -140.65 10.52 2.25 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 125.261 1.424 . . . . 0.0 114.059 -175.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 14.8 m -75.22 25.2 0.1 Allowed 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 127.106 2.162 . . . . 0.0 115.356 -172.854 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -159.68 -178.22 33.48 Favored Glycine 0 CA--C 1.535 1.301 0 C-N-CA 124.932 1.253 . . . . 0.0 114.538 -175.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 19.8 m -57.9 154.49 12.17 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 125.628 1.571 . . . . 0.0 114.105 -176.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 5.0 t -134.69 1.24 3.06 Favored 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 114.71 1.374 . . . . 0.0 114.71 -175.503 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 157.54 -36.96 0.55 Allowed Glycine 0 CA--C 1.534 1.247 0 O-C-N 121.331 -0.856 . . . . 0.0 115.146 170.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 165.29 -168.62 39.44 Favored Glycine 0 CA--C 1.539 1.559 0 CA-C-N 118.037 0.919 . . . . 0.0 114.077 -175.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 94.6 Cg_endo -72.42 2.45 5.09 Favored 'Trans proline' 0 CA--C 1.545 1.054 0 C-N-CA 124.664 3.576 . . . . 0.0 114.543 178.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 12.4 m-20 -63.74 1.4 0.62 Allowed 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 126.987 2.115 . . . . 0.0 115.466 -179.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -123.69 11.38 9.12 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 127.188 2.195 . . . . 0.0 113.769 -178.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 82.4 mt-30 -58.79 156.25 25.97 Favored Pre-proline 0 CA--C 1.554 1.129 0 C-N-CA 124.906 1.282 . . . . 0.0 113.2 173.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -68.23 171.87 12.01 Favored 'Trans proline' 0 CA--C 1.544 0.986 0 C-N-CA 123.956 3.104 . . . . 0.0 114.345 -176.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 23.0 pttp -139.29 -179.99 6.2 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.331 1.852 . . . . 0.0 112.954 -171.153 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.8 mmt-85 -137.86 4.07 2.51 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 125.707 1.603 . . . . 0.0 114.57 -177.29 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 9.2 m-20 -61.49 -15.44 37.82 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 125.137 1.375 . . . . 0.0 114.346 -179.681 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 56.7 p-80 -106.42 14.91 26.67 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 127.263 2.225 . . . . 0.0 113.236 179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 30.4 t -120.89 143.97 31.34 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 C-N-CA 124.824 1.249 . . . . 0.0 111.008 -176.434 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 88.9 mt -117.0 164.52 14.59 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 127.122 2.169 . . . . 0.0 111.124 177.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -123.04 139.31 54.2 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.734 2.014 . . . . 0.0 107.523 167.401 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.5 t -134.31 140.95 44.92 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 124.723 1.209 . . . . 0.0 109.792 -169.211 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 5.0 m -132.54 133.75 44.12 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.119 1.368 . . . . 0.0 109.735 -177.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -158.98 157.86 28.51 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 124.156 0.982 . . . . 0.0 112.332 -169.388 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -53.49 146.28 43.06 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.876 3.051 . . . . 0.0 113.465 170.26 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -53.86 -25.2 18.63 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 115.057 1.503 . . . . 0.0 115.057 179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -62.53 -18.9 62.97 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.211 1.804 . . . . 0.0 114.381 178.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 17.2 m95 -69.42 157.02 37.89 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 124.568 1.147 . . . . 0.0 112.961 176.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 9.7 mptt -129.38 167.52 17.64 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 126.16 1.784 . . . . 0.0 111.123 173.498 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.2 m -51.98 -33.08 36.35 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 125.113 1.365 . . . . 0.0 111.901 170.392 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 70.3 m -64.26 -43.3 95.29 Favored 'General case' 0 N--CA 1.469 0.479 0 N-CA-C 113.983 1.105 . . . . 0.0 113.983 174.003 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -66.45 -31.5 72.29 Favored 'General case' 0 N--CA 1.473 0.718 0 O-C-N 121.536 -0.728 . . . . 0.0 111.231 174.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.0 mt -70.9 -42.91 69.33 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.796 0.838 . . . . 0.0 111.428 175.31 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 23.2 m-85 -60.89 -40.98 95.13 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 120.99 -1.069 . . . . 0.0 111.797 169.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 40.5 tt0 -60.55 -33.3 72.48 Favored 'General case' 0 CA--C 1.546 0.825 0 CA-C-N 119.613 1.097 . . . . 0.0 112.714 174.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 53.8 tp -76.23 -30.18 57.82 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 124.858 1.263 . . . . 0.0 113.86 177.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 74.0 m-85 -123.65 -13.11 7.56 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 116.662 2.097 . . . . 0.0 116.662 -169.051 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 32.3 t -58.08 -22.19 49.38 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 120.327 1.421 . . . . 0.0 113.635 177.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -54.77 -25.83 30.44 Favored 'General case' 0 CA--C 1.547 0.859 0 N-CA-C 114.403 1.26 . . . . 0.0 114.403 171.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -86.94 -18.73 30.07 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 177.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 140.22 -159.61 26.19 Favored Glycine 0 CA--C 1.532 1.145 0 C-N-CA 124.5 1.048 . . . . 0.0 113.496 -179.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 61.3 t30 -74.77 62.72 1.1 Allowed 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.401 1.48 . . . . 0.0 112.281 172.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 1.2 pp -59.08 168.55 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 126.862 2.065 . . . . 0.0 113.497 178.617 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 41.5 tt0 -130.74 150.59 51.85 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.934 1.294 . . . . 0.0 110.648 177.499 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 61.5 mt -130.97 133.19 63.27 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.834 0 C-N-CA 125.217 1.407 . . . . 0.0 109.077 -174.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 45.9 m -134.94 98.21 3.95 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 125.387 1.475 . . . . 0.0 111.135 -177.5 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 99.2 m95 -57.84 148.52 25.04 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 124.778 1.231 . . . . 0.0 113.942 178.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 33.0 pt -135.36 -19.26 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 125.059 1.343 . . . . 0.0 113.872 170.749 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 4.0 t0 -152.88 176.93 11.3 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 124.776 1.231 . . . . 0.0 111.597 172.599 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -64.95 -12.54 50.84 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.895 1.678 . . . . 0.0 113.51 176.495 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 38.7 p -136.97 5.56 2.82 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.225 2.21 . . . . 0.0 113.234 -173.768 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 75.2 m -146.38 138.59 25.05 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.421 1.088 . . . . 0.0 113.156 -172.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.76 157.79 41.34 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.679 1.192 . . . . 0.0 112.398 176.757 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 75.3 m-85 -89.9 154.84 19.55 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 123.755 0.822 . . . . 0.0 110.027 167.255 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 93.4 t -137.67 124.3 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.787 0 C-N-CA 124.359 1.064 . . . . 0.0 110.15 175.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 7.5 t -93.8 132.71 37.93 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 124.785 1.234 . . . . 0.0 110.751 177.182 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 50.4 mt -111.85 161.1 16.72 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 125.352 1.461 . . . . 0.0 111.129 178.265 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 38.5 m -67.79 -25.92 65.83 Favored 'General case' 0 N--CA 1.473 0.695 0 N-CA-C 114.345 1.239 . . . . 0.0 114.345 -174.143 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -145.55 153.98 52.0 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.187 1.395 . . . . 0.0 111.963 -179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -70.17 -20.85 32.36 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.23 2.62 . . . . 0.0 113.632 175.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -63.17 -35.3 79.83 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 120.79 -1.194 . . . . 0.0 111.818 171.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.8 mt-30 -69.35 -28.14 65.95 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.267 -0.896 . . . . 0.0 112.734 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 25.3 t -62.4 -43.68 98.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 123.586 0.754 . . . . 0.0 111.151 170.471 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 22.4 tm0? -61.39 -41.62 97.41 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 118.75 0.705 . . . . 0.0 111.588 174.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 95.8 mt -62.19 -47.79 91.48 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.368 0.667 . . . . 0.0 111.003 175.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.79 87.74 Favored 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 119.179 0.9 . . . . 0.0 113.383 178.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.23 -27.6 39.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.86 0 C-N-CA 124.181 0.993 . . . . 0.0 112.117 173.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 57.8 t30 -74.53 -46.85 36.43 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 120.935 -1.103 . . . . 0.0 112.144 169.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 57.4 p -74.34 -21.23 59.79 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -174.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 84.8 p -59.49 -23.15 62.53 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 114.285 1.217 . . . . 0.0 114.285 174.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -59.67 -17.75 36.57 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 125.198 1.399 . . . . 0.0 114.102 173.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 24.8 m-85 -100.49 -0.48 37.83 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.961 1.305 . . . . 0.0 113.618 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -67.11 155.59 38.34 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.012 0.925 . . . . 0.0 112.943 176.754 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 -138.22 -4.22 1.71 Allowed 'General case' 0 CA--C 1.549 0.941 0 C-N-CA 125.218 1.407 . . . . 0.0 112.7 174.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 70.7 p -141.75 5.54 1.78 Allowed 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 125.902 1.681 . . . . 0.0 114.1 -172.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.6 p90 -156.68 169.33 24.95 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.273 1.829 . . . . 0.0 111.055 178.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 82.4 mtm180 -141.1 149.33 41.44 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 127.147 2.179 . . . . 0.0 110.411 178.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 86.8 mt -137.65 142.82 35.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.915 0 C-N-CA 125.633 1.573 . . . . 0.0 110.098 -177.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.7 pt20 -144.22 164.48 30.6 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 126.51 1.924 . . . . 0.0 109.566 168.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 20.3 p -71.0 162.05 30.08 Favored 'General case' 0 N--CA 1.479 0.999 0 O-C-N 120.374 -1.454 . . . . 0.0 111.775 174.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 37.0 t80 -58.17 -36.97 73.81 Favored 'General case' 0 CA--C 1.542 0.669 0 O-C-N 121.265 -0.897 . . . . 0.0 111.834 169.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -65.5 -39.73 92.22 Favored 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 123.643 0.777 . . . . 0.0 113.068 176.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -63.7 -39.75 95.08 Favored 'General case' 0 N--CA 1.472 0.665 0 O-C-N 121.379 -0.826 . . . . 0.0 112.029 173.428 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 82.5 t80 -65.41 -45.43 83.99 Favored 'General case' 0 CA--C 1.541 0.63 0 C-N-CA 122.941 0.496 . . . . 0.0 112.067 172.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 6.7 t -57.43 -43.15 82.12 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.907 0 C-N-CA 124.748 1.219 . . . . 0.0 112.615 176.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -61.9 -27.23 68.26 Favored Glycine 0 CA--C 1.539 1.567 0 CA-C-N 118.244 0.475 . . . . 0.0 113.604 177.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -84.64 -34.32 23.1 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 125.452 1.501 . . . . 0.0 112.509 172.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 38.7 ttpt -56.81 -25.79 56.57 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 126.337 1.855 . . . . 0.0 113.753 175.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 18.7 mm100 -51.34 -21.21 2.08 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 125.605 1.562 . . . . 0.0 115.016 176.14 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -59.07 -17.35 25.1 Favored 'General case' 0 N--CA 1.479 1.021 0 N-CA-C 115.243 1.572 . . . . 0.0 115.243 170.311 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -151.38 42.72 0.71 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 125.705 1.621 . . . . 0.0 113.287 -174.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.42 5.51 10.16 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 125.787 1.635 . . . . 0.0 113.591 -172.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 4.1 mp0 -109.31 -7.95 15.16 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 125.24 1.416 . . . . 0.0 113.337 -179.371 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 19.4 m -144.28 163.04 14.64 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 126.447 1.899 . . . . 0.0 111.234 -177.81 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 65.1 mttp -67.68 -29.96 69.37 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 124.077 0.951 . . . . 0.0 113.367 175.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 25.5 m -63.74 138.81 58.64 Favored 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 125.206 1.402 . . . . 0.0 112.902 -179.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 148.08 -55.05 0.51 Allowed Glycine 0 CA--C 1.539 1.574 0 C-N-CA 124.613 1.101 . . . . 0.0 114.232 176.165 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo -55.11 153.03 27.93 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 124.307 3.338 . . . . 0.0 115.003 177.551 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 67.5 p -70.54 -8.28 50.2 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 178.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 61.3 p -67.75 -12.66 61.03 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 115.182 1.549 . . . . 0.0 115.182 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.102 0 C-N-CA 125.092 1.329 . . . . 0.0 113.056 177.98 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.419 -2.804 0 O5'-C5'-C4' 113.861 2.615 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.497 0 N-CA-C 112.022 -0.431 . . . . 0.0 112.022 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 19.8 m -63.42 -19.52 64.76 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 -173.639 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 22.6 m -136.78 7.79 3.0 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.984 1.313 . . . . 0.0 114.014 -173.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 169.64 178.0 40.49 Favored Glycine 0 CA--C 1.534 1.254 0 C-N-CA 124.155 0.883 . . . . 0.0 114.287 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 80.7 p -138.41 2.33 2.25 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 125.43 1.492 . . . . 0.0 114.565 -175.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 2.7 t -143.04 21.97 1.92 Allowed 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 125.477 1.511 . . . . 0.0 112.586 -178.037 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -174.24 172.08 45.06 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.861 1.696 . . . . 0.0 112.513 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 166.07 -167.28 39.19 Favored Glycine 0 CA--C 1.54 1.642 0 C-N-CA 123.819 0.723 . . . . 0.0 114.155 -174.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -68.45 177.02 5.02 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 124.021 3.148 . . . . 0.0 112.573 173.389 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 22.7 t70 57.89 23.97 10.38 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 126.11 1.764 . . . . 0.0 114.494 -174.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 96.4 mt -127.16 6.23 6.46 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 126.555 1.942 . . . . 0.0 112.773 177.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 37.48 65.4 2.6 Favored Pre-proline 0 CA--C 1.553 1.093 0 C-N-CA 127.35 2.26 . . . . 0.0 114.495 -174.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 59.6 Cg_exo -53.15 -23.58 23.01 Favored 'Trans proline' 0 C--N 1.356 0.935 0 C-N-CA 124.33 3.353 . . . . 0.0 116.449 -177.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 62.2 mtpt -137.29 142.95 41.92 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.151 1.78 . . . . 0.0 110.894 178.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 69.2 mtt85 -138.92 14.36 2.67 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 126.054 1.742 . . . . 0.0 113.523 174.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -62.79 -19.75 64.33 Favored 'General case' 0 CA--C 1.548 0.886 0 O-C-N 121.029 -1.044 . . . . 0.0 113.327 179.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 38.4 p-80 -94.66 12.71 26.76 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 127.546 2.338 . . . . 0.0 113.795 175.295 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 29.3 t -120.11 141.96 37.98 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.98 0 C-N-CA 125.108 1.363 . . . . 0.0 111.656 -171.305 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 65.7 mt -117.13 166.68 11.94 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 127.388 2.275 . . . . 0.0 110.975 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 20.9 t-80 -123.92 142.24 51.32 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 126.779 2.031 . . . . 0.0 107.883 167.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.3 t -134.74 138.6 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 124.999 1.319 . . . . 0.0 109.024 -171.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 3.7 m -125.44 135.79 52.71 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.828 1.251 . . . . 0.0 109.621 179.513 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 7.9 p90 -155.49 153.35 26.36 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 124.689 1.196 . . . . 0.0 112.059 -169.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 57.9 Cg_exo -52.42 147.51 29.13 Favored 'Trans proline' 0 CA--C 1.537 0.664 0 C-N-CA 123.818 3.012 . . . . 0.0 113.209 169.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 ptmt -57.95 -18.7 25.14 Favored 'General case' 0 N--CA 1.481 1.122 0 N-CA-C 115.367 1.618 . . . . 0.0 115.367 -178.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -81.27 -15.74 54.64 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 125.561 1.544 . . . . 0.0 114.0 178.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 6.6 m95 -61.43 151.38 32.72 Favored 'General case' 0 N--CA 1.474 0.728 0 CA-C-N 119.224 0.92 . . . . 0.0 112.323 175.118 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -119.1 165.32 14.31 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 126.005 1.722 . . . . 0.0 111.869 178.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.7 m -51.77 -34.57 40.22 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.991 1.316 . . . . 0.0 111.509 168.06 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.8 m -65.99 -41.73 90.7 Favored 'General case' 0 N--CA 1.467 0.388 0 N-CA-C 113.701 1.0 . . . . 0.0 113.701 175.405 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -64.98 -31.39 72.6 Favored 'General case' 0 N--CA 1.474 0.731 0 O-C-N 121.599 -0.688 . . . . 0.0 111.183 173.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 72.8 mt -70.5 -47.41 60.65 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.653 0.781 . . . . 0.0 111.359 174.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 7.0 m-85 -59.91 -32.04 70.38 Favored 'General case' 0 CA--C 1.541 0.616 0 O-C-N 120.93 -1.106 . . . . 0.0 113.064 171.286 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 20.9 tm0? -69.86 -42.67 73.22 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 119.148 0.886 . . . . 0.0 112.113 172.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 55.6 tp -62.11 -33.57 74.69 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.162 1.385 . . . . 0.0 112.253 179.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 94.7 m-85 -108.28 12.91 26.13 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.663 1.185 . . . . 0.0 113.536 -179.094 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 23.2 t -56.3 -30.32 62.37 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 125.026 1.33 . . . . 0.0 113.281 178.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.64 -14.81 9.25 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.637 1.575 . . . . 0.0 115.081 175.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -111.26 -4.71 14.86 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 124.9 1.28 . . . . 0.0 113.684 -175.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 72.86 -31.07 0.75 Allowed Glycine 0 CA--C 1.539 1.556 0 C-N-CA 126.425 1.964 . . . . 0.0 117.196 169.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 14.8 t30 -148.07 129.23 14.6 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 125.862 1.665 . . . . 0.0 110.624 -176.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 26.8 pt -146.07 173.5 3.14 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.752 0 C-N-CA 125.556 1.542 . . . . 0.0 112.089 -176.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 45.9 tt0 -142.0 144.5 33.7 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 125.298 1.439 . . . . 0.0 108.59 167.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 49.7 mt -127.42 133.7 67.32 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 124.192 0.997 . . . . 0.0 109.993 -172.057 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 70.6 m -136.9 103.25 5.11 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 125.551 1.541 . . . . 0.0 110.529 -179.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 74.5 m95 -60.73 158.85 11.93 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 124.768 1.227 . . . . 0.0 114.249 -176.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.8 -28.68 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.694 1.197 . . . . 0.0 112.252 171.427 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -154.1 -178.5 7.14 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.878 1.271 . . . . 0.0 111.471 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 10.4 m-20 -61.74 -19.68 62.7 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.892 1.277 . . . . 0.0 113.065 171.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.8 p -132.31 5.64 4.11 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 126.99 2.116 . . . . 0.0 113.525 -169.502 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 18.9 m -144.08 139.88 29.17 Favored 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 124.667 1.187 . . . . 0.0 113.126 -175.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.13 155.2 38.42 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 125.241 1.416 . . . . 0.0 112.074 174.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -89.4 149.74 22.85 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 124.421 1.088 . . . . 0.0 109.67 167.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 58.2 t -137.3 115.52 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.696 0 C-N-CA 124.281 1.032 . . . . 0.0 110.314 177.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 67.9 m -80.6 142.51 33.98 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 124.489 1.116 . . . . 0.0 110.838 170.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 68.6 mt -119.76 160.73 22.02 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 125.118 1.367 . . . . 0.0 110.843 172.517 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 65.4 m -61.57 -27.45 68.64 Favored 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 115.049 1.5 . . . . 0.0 115.049 -175.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 21.9 mp0 -144.37 152.65 54.27 Favored Pre-proline 0 CA--C 1.546 0.824 0 C-N-CA 125.139 1.376 . . . . 0.0 111.573 176.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -68.24 -12.83 36.22 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 123.891 3.06 . . . . 0.0 114.032 172.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -66.5 -38.84 88.12 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.749 -1.219 . . . . 0.0 111.683 169.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 63.0 mm-40 -74.62 -25.33 59.16 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.637 0.775 . . . . 0.0 112.788 -177.191 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 51.7 t -54.85 -44.15 70.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 125.437 1.495 . . . . 0.0 111.179 171.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 67.5 mt-30 -65.41 -36.18 83.17 Favored 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 124.014 0.925 . . . . 0.0 112.045 178.731 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 61.3 mt -64.72 -47.92 86.74 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.316 1.047 . . . . 0.0 110.49 177.031 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -64.38 -34.85 79.12 Favored 'General case' 0 CA--C 1.545 0.758 0 N-CA-C 113.532 0.938 . . . . 0.0 113.532 179.245 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 78.1 t -65.8 -41.14 89.59 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 O-C-N 121.058 -1.027 . . . . 0.0 111.11 170.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 52.9 t30 -62.66 -42.58 99.69 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 176.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 41.7 p -72.96 -31.38 64.52 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.739 0.816 . . . . 0.0 113.028 -178.209 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 10.3 t -65.04 -16.39 63.39 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 174.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.6 tptt -55.29 -21.88 16.4 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 125.383 1.473 . . . . 0.0 114.001 176.734 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -124.79 16.41 8.68 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.78 1.632 . . . . 0.0 112.994 -175.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.22 159.47 17.65 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.293 1.037 . . . . 0.0 113.113 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -135.8 -8.92 2.12 Favored 'General case' 0 CA--C 1.549 0.921 0 C-N-CA 125.027 1.331 . . . . 0.0 113.098 179.429 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 71.4 p -140.54 2.43 1.82 Allowed 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.497 1.519 . . . . 0.0 114.432 -172.22 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 50.5 p90 -157.49 176.07 13.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.438 1.895 . . . . 0.0 110.794 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -147.55 147.21 29.86 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.309 1.444 . . . . 0.0 110.827 169.503 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 76.0 mt -129.77 142.05 44.88 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 126.237 1.815 . . . . 0.0 109.694 179.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -146.55 163.14 36.71 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.789 1.636 . . . . 0.0 110.79 170.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 19.2 p -71.1 164.97 24.53 Favored 'General case' 0 N--CA 1.482 1.169 0 O-C-N 120.644 -1.285 . . . . 0.0 112.192 173.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 31.8 t80 -58.61 -39.4 80.35 Favored 'General case' 0 CA--C 1.545 0.771 0 O-C-N 121.038 -1.039 . . . . 0.0 111.983 169.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -64.8 -34.29 78.0 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 123.802 0.841 . . . . 0.0 113.195 177.344 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 52.1 mt-10 -71.84 -40.66 68.91 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.349 -0.845 . . . . 0.0 112.142 170.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -60.71 -36.33 78.53 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.954 1.302 . . . . 0.0 113.559 177.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 3.2 t -46.4 -37.93 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 C-N-CA 125.206 1.402 . . . . 0.0 113.749 178.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -69.13 -9.09 59.69 Favored Glycine 0 CA--C 1.543 1.821 0 N-CA-C 115.376 0.91 . . . . 0.0 115.376 178.547 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 5.8 mptt -124.74 5.3 8.14 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 127.904 2.481 . . . . 0.0 113.127 178.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -62.64 -30.98 71.77 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 126.205 1.802 . . . . 0.0 114.386 -173.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -69.26 157.35 37.13 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 124.407 1.083 . . . . 0.0 112.806 173.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 56.2 mtpt -138.26 164.79 28.34 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 125.669 1.588 . . . . 0.0 111.549 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -136.88 23.36 3.22 Favored Glycine 0 CA--C 1.537 1.413 0 C-N-CA 125.303 1.43 . . . . 0.0 114.429 -175.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -130.61 18.59 5.22 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 126.37 1.868 . . . . 0.0 112.721 -176.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 57.0 tp60 -146.53 130.37 17.14 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.458 1.903 . . . . 0.0 109.83 -176.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 27.6 m -70.05 149.98 10.28 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.005 0.922 . . . . 0.0 112.066 175.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -78.43 -11.32 59.94 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.721 1.208 . . . . 0.0 113.949 178.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 16.3 m -60.52 160.91 8.22 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 126.244 1.818 . . . . 0.0 113.497 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -169.89 172.53 43.81 Favored Glycine 0 CA--C 1.54 1.612 0 C-N-CA 124.209 0.909 . . . . 0.0 114.194 176.495 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_endo -79.71 -0.71 10.92 Favored 'Trans proline' 0 CA--C 1.546 1.075 0 C-N-CA 124.774 3.649 . . . . 0.0 114.778 -173.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 58.8 p -65.26 -13.6 58.75 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 115.51 1.67 . . . . 0.0 115.51 -175.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 91.0 p -150.51 166.89 28.81 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.427 1.491 . . . . 0.0 112.612 175.667 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.229 0 C-N-CA 125.235 1.398 . . . . 0.0 112.816 179.606 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . 0.429 ' H81' " O4'" ' A' ' 524' ' ' GDP . . . . . . . . 0 O4'--C4' 1.419 -2.84 0 C5'-C4'-O4' 113.118 2.798 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . 0.429 " O4'" ' H81' ' A' ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.45 0 N-CA-C 111.67 -0.572 . . . . 0.0 111.67 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 80.7 p -69.95 168.77 14.63 Favored 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 124.87 1.268 . . . . 0.0 113.514 175.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 25.0 m -132.19 4.15 4.04 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.925 1.29 . . . . 0.0 114.133 -177.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -179.76 24.62 0.04 OUTLIER Glycine 0 CA--C 1.537 1.429 0 C-N-CA 124.307 0.956 . . . . 0.0 115.213 -178.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 34.3 p -64.86 -12.71 51.56 Favored 'General case' 0 N--CA 1.477 0.907 0 N-CA-C 115.209 1.559 . . . . 0.0 115.209 -174.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 89.6 p -64.69 -26.11 68.24 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.524 1.129 . . . . 0.0 113.681 170.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 61.36 18.27 55.12 Favored Glycine 0 CA--C 1.54 1.631 0 C-N-CA 124.796 1.189 . . . . 0.0 114.63 -173.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -178.15 68.47 0.08 OUTLIER Glycine 0 CA--C 1.536 1.361 0 CA-C-N 118.288 1.044 . . . . 0.0 113.569 -171.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -69.31 -24.76 31.39 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 123.371 2.714 . . . . 0.0 113.668 179.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 22.0 t0 -72.71 140.77 48.05 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.368 1.067 . . . . 0.0 111.626 171.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 95.9 mt -130.57 3.78 4.61 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.692 1.597 . . . . 0.0 113.445 -176.381 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 91.3 mm-40 -66.99 158.8 79.75 Favored Pre-proline 0 CA--C 1.55 0.97 0 C-N-CA 123.83 0.852 . . . . 0.0 112.134 172.675 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_exo -51.23 144.25 30.57 Favored 'Trans proline' 0 CA--C 1.54 0.776 0 C-N-CA 123.725 2.95 . . . . 0.0 113.509 172.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 8.8 mtpm? -82.47 -41.25 20.03 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -176.513 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -141.23 -12.25 0.93 Allowed 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 126.523 1.929 . . . . 0.0 114.89 -172.777 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -65.9 -17.75 64.87 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 113.974 1.101 . . . . 0.0 113.974 -173.609 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 38.1 p-80 -100.17 14.41 30.9 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 127.434 2.294 . . . . 0.0 113.352 176.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 23.4 t -120.54 133.28 67.74 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.858 0 C-N-CA 124.665 1.186 . . . . 0.0 111.649 -170.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 94.1 mt -103.81 166.63 10.29 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.842 2.057 . . . . 0.0 111.669 175.691 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -125.32 138.75 54.07 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 127.371 2.268 . . . . 0.0 107.413 167.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.2 t -135.61 138.64 47.76 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 C-N-CA 124.822 1.249 . . . . 0.0 109.165 -170.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 6.9 m -126.62 131.25 51.52 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 124.919 1.288 . . . . 0.0 109.23 -179.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 11.8 p90 -150.51 160.37 32.93 Favored Pre-proline 0 CA--C 1.549 0.911 0 C-N-CA 124.678 1.191 . . . . 0.0 112.925 -168.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_exo -54.13 156.59 12.76 Favored 'Trans proline' 0 C--N 1.35 0.606 0 C-N-CA 124.658 3.572 . . . . 0.0 115.32 177.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.9 pttp -58.01 -12.64 3.52 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.396 1.878 . . . . 0.0 115.913 174.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -117.63 -1.03 11.71 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.791 1.636 . . . . 0.0 113.848 -177.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 1.7 m0 -66.81 154.28 41.25 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.223 -0.923 . . . . 0.0 111.874 169.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -129.54 166.47 19.61 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.097 1.359 . . . . 0.0 113.278 -174.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.3 m -47.29 -33.38 5.56 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 125.909 1.684 . . . . 0.0 112.865 170.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 20.2 p -72.9 -41.06 65.0 Favored 'General case' 0 N--CA 1.464 0.226 0 N-CA-C 114.342 1.238 . . . . 0.0 114.342 177.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 43.8 m-20 -60.49 -28.23 68.2 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 118.551 0.614 . . . . 0.0 110.33 168.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.2 mt -78.36 -46.2 20.59 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 122.544 0.338 . . . . 0.0 111.782 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.2 m-85 -58.11 -39.64 79.15 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.055 -1.028 . . . . 0.0 111.989 169.676 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 47.5 tt0 -64.37 -34.45 78.18 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 119.166 0.893 . . . . 0.0 112.869 174.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 44.1 tp -71.52 -28.9 64.21 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 124.172 0.989 . . . . 0.0 113.141 177.455 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 75.4 m-85 -121.7 3.85 10.08 Favored 'General case' 0 N--CA 1.478 0.964 0 N-CA-C 115.89 1.811 . . . . 0.0 115.89 -172.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 75.3 p -56.77 -24.57 51.22 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 114.559 1.318 . . . . 0.0 114.559 176.874 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.12 -15.06 8.17 Favored 'General case' 0 CA--C 1.549 0.905 0 C-N-CA 125.568 1.547 . . . . 0.0 114.624 173.437 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -106.15 3.55 28.09 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 125.342 1.457 . . . . 0.0 113.861 -177.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 82.55 -45.44 3.38 Favored Glycine 0 CA--C 1.534 1.242 0 C-N-CA 125.879 1.704 . . . . 0.0 115.572 169.203 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 28.0 t-20 -150.85 143.91 24.7 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.935 1.294 . . . . 0.0 111.127 177.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 24.1 pt -144.78 171.42 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 125.209 1.404 . . . . 0.0 112.076 -175.583 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 53.1 tp60 -138.33 105.68 5.52 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 124.244 1.018 . . . . 0.0 109.521 167.197 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.9 mt -74.53 135.72 26.78 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.598 0 C-N-CA 124.094 0.958 . . . . 0.0 108.477 172.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 58.7 m -138.99 96.71 3.16 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 126.503 1.921 . . . . 0.0 109.523 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -58.18 155.94 10.51 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 -173.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 8.5 mt -131.72 -41.1 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.68 0 C-N-CA 125.177 1.391 . . . . 0.0 110.054 176.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -156.49 179.89 8.83 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 125.443 1.497 . . . . 0.0 111.441 178.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -56.23 -20.26 17.52 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.619 1.968 . . . . 0.0 114.087 173.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.6 p -131.42 4.02 4.29 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 126.273 1.829 . . . . 0.0 113.778 -173.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 69.5 m -144.4 139.42 28.4 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.12 0.968 . . . . 0.0 112.894 -174.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -149.88 152.02 34.39 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.669 1.188 . . . . 0.0 112.24 175.478 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -89.42 151.73 21.87 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 123.829 0.852 . . . . 0.0 108.788 167.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 49.3 t -140.51 111.14 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 123.867 0.867 . . . . 0.0 110.591 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 72.4 m -73.84 143.71 45.8 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.796 0.838 . . . . 0.0 110.629 169.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 67.3 mt -118.81 164.63 15.12 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 125.701 1.6 . . . . 0.0 110.516 171.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 63.3 m -62.71 -28.86 70.24 Favored 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 114.308 1.225 . . . . 0.0 114.308 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -144.35 152.75 54.6 Favored Pre-proline 0 CA--C 1.544 0.745 0 C-N-CA 124.701 1.2 . . . . 0.0 112.346 -177.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.94 -16.67 32.55 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.457 2.771 . . . . 0.0 113.807 173.434 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -65.41 -38.48 90.05 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.946 -1.096 . . . . 0.0 111.813 170.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -67.13 -31.04 71.22 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 124.259 1.024 . . . . 0.0 112.338 179.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 43.4 t -58.28 -40.04 76.23 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 123.986 0.914 . . . . 0.0 111.283 171.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 50.4 mm-40 -65.77 -38.37 88.87 Favored 'General case' 0 N--CA 1.471 0.584 0 O-C-N 121.62 -0.675 . . . . 0.0 111.683 178.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 78.8 mt -65.3 -44.51 94.87 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.236 1.014 . . . . 0.0 110.669 175.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.21 -41.14 99.1 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 121.324 -0.86 . . . . 0.0 112.868 176.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 57.8 t -67.52 -31.56 53.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 124.147 0.979 . . . . 0.0 112.303 175.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 53.1 t30 -69.4 -49.73 52.61 Favored 'General case' 0 CA--C 1.542 0.657 0 O-C-N 121.028 -1.045 . . . . 0.0 111.854 171.139 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 23.7 p -71.37 -24.46 62.09 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 114.001 1.112 . . . . 0.0 114.001 -174.185 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 60.1 p -67.1 -14.29 62.76 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 115.011 1.486 . . . . 0.0 115.011 176.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -59.88 -16.14 26.88 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.81 1.244 . . . . 0.0 113.734 169.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -119.17 10.95 12.21 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.628 1.571 . . . . 0.0 112.777 -172.128 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.68 164.24 10.13 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.97 1.308 . . . . 0.0 112.657 170.052 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -136.53 -27.95 1.03 Allowed 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 114.03 1.122 . . . . 0.0 114.03 -177.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 42.9 m -133.4 5.65 3.77 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.673 1.189 . . . . 0.0 113.856 -175.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 49.9 p90 -150.41 176.16 11.18 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.581 1.952 . . . . 0.0 110.468 -176.315 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 27.3 tpt180 -144.27 150.77 38.43 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.547 1.139 . . . . 0.0 111.397 173.179 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 34.2 mt -133.87 140.1 47.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 C-N-CA 126.345 1.858 . . . . 0.0 108.541 177.572 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 25.9 pt20 -149.65 172.43 15.06 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.101 1.76 . . . . 0.0 110.319 174.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 32.3 p -72.61 163.14 28.54 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.715 -1.241 . . . . 0.0 111.959 171.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 60.0 t80 -54.54 -41.66 70.02 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.267 -0.896 . . . . 0.0 111.848 169.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.76 -35.76 80.85 Favored 'General case' 0 CA--C 1.544 0.735 0 N-CA-C 113.656 0.984 . . . . 0.0 113.656 179.325 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 22.4 mm-40 -68.68 -33.2 73.56 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 121.024 -1.048 . . . . 0.0 112.926 175.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -67.0 -46.99 72.88 Favored 'General case' 0 CA--C 1.541 0.601 0 O-C-N 121.721 -0.612 . . . . 0.0 111.813 170.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 24.6 t -59.7 -41.51 85.54 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 124.381 1.072 . . . . 0.0 112.365 174.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -66.66 -38.65 93.39 Favored Glycine 0 CA--C 1.534 1.238 0 O-C-N 121.486 -0.759 . . . . 0.0 113.956 -172.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -16.83 58.13 Favored 'General case' 0 N--CA 1.48 1.026 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 174.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 75.9 tttt -56.17 -28.71 59.12 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 125.345 1.458 . . . . 0.0 113.291 179.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -69.01 -12.43 61.68 Favored 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 125.572 1.549 . . . . 0.0 114.509 174.504 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 59.5 mtpt -127.29 -30.65 2.62 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 125.642 1.577 . . . . 0.0 113.75 -175.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 110.18 -169.52 13.6 Favored Glycine 0 CA--C 1.536 1.368 0 C-N-CA 125.148 1.356 . . . . 0.0 114.252 174.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -60.69 159.12 11.35 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 125.041 1.336 . . . . 0.0 112.423 173.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 53.0 mt-30 -126.78 -7.0 6.17 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 124.692 1.197 . . . . 0.0 113.956 -176.518 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.5 m -78.7 -15.16 13.72 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.187 0 C-N-CA 124.631 1.172 . . . . 0.0 113.65 175.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -153.31 171.74 18.1 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.895 2.078 . . . . 0.0 111.53 -179.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 44.9 p -150.67 -51.73 0.13 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 124.329 1.052 . . . . 0.0 112.958 175.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 65.15 -173.73 18.32 Favored Glycine 0 CA--C 1.545 1.912 0 C-N-CA 124.545 1.069 . . . . 0.0 114.859 -179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -71.88 165.73 31.68 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.771 2.981 . . . . 0.0 112.438 174.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 68.4 m -140.78 149.26 41.85 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 125.202 1.401 . . . . 0.0 111.871 -178.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 22.8 m -71.81 -16.0 62.16 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 114.724 1.379 . . . . 0.0 114.724 -178.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.199 0 C-N-CA 125.738 1.637 . . . . 0.0 113.0 -178.554 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . 0.401 ' H81' " O4'" ' A' ' 524' ' ' GDP . . . . . . . . 0 O4'--C4' 1.421 -2.653 0 C5'-C4'-O4' 111.8 1.857 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . 0.401 " O4'" ' H81' ' A' ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.65 0 N-CA-C 111.822 -0.511 . . . . 0.0 111.822 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 78.6 p -137.15 -7.73 1.79 Allowed 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 115.153 1.538 . . . . 0.0 115.153 -173.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 28.3 p -69.46 -29.94 67.73 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 124.695 1.198 . . . . 0.0 113.518 174.206 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 153.87 178.71 28.61 Favored Glycine 0 CA--C 1.534 1.261 0 C-N-CA 126.037 1.779 . . . . 0.0 112.508 177.27 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 25.4 m -59.33 -22.36 61.15 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 124.18 0.992 . . . . 0.0 113.617 175.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 14.6 m -66.94 -10.57 50.49 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 126.526 1.93 . . . . 0.0 114.685 173.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -69.84 46.36 0.57 Allowed Glycine 0 CA--C 1.538 1.476 0 C-N-CA 127.588 2.518 . . . . 0.0 116.234 -175.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 169.46 -56.55 0.2 Allowed Glycine 0 CA--C 1.54 1.634 0 C-N-CA 126.265 1.888 . . . . 0.0 113.185 -176.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 83.9 Cg_endo -80.09 -2.49 12.1 Favored 'Trans proline' 0 CA--C 1.545 1.053 0 C-N-CA 123.593 2.862 . . . . 0.0 114.823 -179.194 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 3.2 t0 -140.14 168.25 20.26 Favored 'General case' 0 CA--C 1.548 0.889 0 C-N-CA 124.482 1.113 . . . . 0.0 112.651 -177.636 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 85.5 mt -88.77 156.92 18.68 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 125.696 1.598 . . . . 0.0 113.157 -172.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 82.7 mt-30 35.09 52.58 1.49 Allowed Pre-proline 0 CA--C 1.554 1.13 0 C-N-CA 127.713 2.405 . . . . 0.0 116.155 -178.369 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_exo -54.3 -31.32 66.55 Favored 'Trans proline' 0 C--N 1.355 0.907 0 C-N-CA 122.928 2.418 . . . . 0.0 114.535 -177.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -71.28 -3.77 22.27 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 126.729 2.012 . . . . 0.0 115.813 176.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 37.4 mmt180 -133.34 -18.73 2.22 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 125.778 1.631 . . . . 0.0 113.844 175.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -63.04 -14.29 46.28 Favored 'General case' 0 CA--C 1.549 0.927 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 177.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 42.3 p-80 -93.62 7.7 43.7 Favored 'General case' 0 CA--C 1.547 0.863 0 C-N-CA 125.701 1.6 . . . . 0.0 114.0 173.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 19.0 t -117.64 139.07 46.22 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 C-N-CA 124.711 1.204 . . . . 0.0 111.772 -170.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.7 mt -113.15 166.3 11.57 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.711 2.004 . . . . 0.0 111.537 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 32.8 t-80 -127.72 140.9 51.78 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.526 2.331 . . . . 0.0 107.88 168.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.2 t -136.18 141.04 42.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.959 1.304 . . . . 0.0 109.498 -169.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 6.7 m -134.14 136.14 43.62 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.724 1.209 . . . . 0.0 109.848 -179.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 6.7 p90 -158.86 159.04 29.59 Favored Pre-proline 0 CA--C 1.55 0.949 0 C-N-CA 124.277 1.031 . . . . 0.0 112.679 -169.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 60.3 Cg_exo -52.6 147.53 30.27 Favored 'Trans proline' 0 C--N 1.351 0.695 0 C-N-CA 124.225 3.284 . . . . 0.0 114.069 171.319 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -60.72 -12.74 11.41 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 115.854 1.798 . . . . 0.0 115.854 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -75.11 -17.59 60.4 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.879 1.272 . . . . 0.0 113.953 176.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.5 m95 -65.39 154.77 37.43 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -178.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -119.79 164.81 15.41 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 127.044 2.138 . . . . 0.0 111.697 173.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 4.6 m -55.81 -31.64 62.85 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.163 0.985 . . . . 0.0 110.908 168.039 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 66.0 m -64.53 -40.85 96.37 Favored 'General case' 0 N--CA 1.468 0.426 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 172.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -66.49 -30.24 70.53 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 121.613 -0.679 . . . . 0.0 111.202 173.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 49.7 mt -70.5 -44.81 66.86 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 123.354 0.662 . . . . 0.0 111.542 173.478 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.7 m-85 -57.73 -39.61 77.71 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 120.993 -1.067 . . . . 0.0 111.962 169.531 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 64.3 tp60 -67.82 -33.18 74.28 Favored 'General case' 0 CA--C 1.547 0.831 0 CA-C-N 119.075 0.852 . . . . 0.0 113.257 175.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.5 tp -69.87 -32.02 70.16 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 124.467 1.107 . . . . 0.0 112.725 176.247 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 82.2 m-85 -115.96 6.02 14.08 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.6 1.333 . . . . 0.0 114.6 -172.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 79.2 p -58.54 -23.85 59.24 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.941 1.297 . . . . 0.0 114.349 175.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.23 -13.09 4.33 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.622 1.569 . . . . 0.0 114.38 172.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 27.8 m-85 -114.21 5.23 15.8 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.847 1.659 . . . . 0.0 113.304 -176.721 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 72.02 -122.57 9.08 Favored Glycine 0 CA--C 1.532 1.134 0 C-N-CA 124.473 1.035 . . . . 0.0 112.576 177.493 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 20.4 t30 -60.64 128.48 36.81 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.412 1.085 . . . . 0.0 111.862 173.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 28.4 pt -142.67 167.52 14.59 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 125.807 1.643 . . . . 0.0 110.894 177.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 59.4 mt-30 -137.98 99.51 3.91 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 125.155 1.382 . . . . 0.0 110.537 176.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 56.3 mt -79.74 143.2 12.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 125.612 1.565 . . . . 0.0 109.644 177.265 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 7.9 t -141.14 111.61 6.89 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.937 1.295 . . . . 0.0 111.399 175.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 92.3 m95 -62.39 154.2 28.91 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 179.518 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 7.3 mt -132.68 -44.34 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 124.982 1.313 . . . . 0.0 110.115 179.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 41.4 t0 -153.03 177.38 10.85 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 126.326 1.85 . . . . 0.0 109.416 170.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.26 1.13 2.3 Favored 'General case' 0 CA--C 1.547 0.857 0 N-CA-C 115.454 1.65 . . . . 0.0 115.454 -174.784 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 69.1 p -138.09 5.29 2.54 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 127.259 2.224 . . . . 0.0 113.199 -175.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 88.2 p -154.2 149.36 26.94 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 114.388 1.255 . . . . 0.0 114.388 179.29 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.39 152.48 33.16 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 125.109 1.364 . . . . 0.0 111.919 -176.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 83.2 m-85 -89.42 153.96 20.43 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 108.528 -0.916 . . . . 0.0 108.528 166.739 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 40.6 t -139.54 109.73 4.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 C-N-CA 123.548 0.739 . . . . 0.0 110.081 175.118 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 24.7 m -77.33 132.76 38.75 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 124.358 1.063 . . . . 0.0 109.53 168.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 77.0 mt -112.35 158.59 19.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.997 1.319 . . . . 0.0 110.516 176.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 58.5 m -68.12 -21.5 64.94 Favored 'General case' 0 N--CA 1.474 0.774 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -174.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -143.28 150.75 52.99 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 124.896 1.278 . . . . 0.0 111.751 177.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -69.74 -16.54 37.7 Favored 'Trans proline' 0 CA--C 1.54 0.81 0 C-N-CA 123.463 2.775 . . . . 0.0 113.747 175.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 21.1 mm-40 -65.58 -36.51 83.98 Favored 'General case' 0 N--CA 1.474 0.758 0 O-C-N 121.038 -1.039 . . . . 0.0 112.161 171.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -69.35 -31.88 70.6 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.456 1.102 . . . . 0.0 112.073 -178.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 38.6 t -57.01 -42.01 78.45 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 124.806 1.242 . . . . 0.0 111.462 171.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 52.8 mm-40 -64.52 -39.17 93.29 Favored 'General case' 0 N--CA 1.471 0.6 0 O-C-N 121.886 -0.509 . . . . 0.0 111.697 -179.639 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 80.8 mt -64.98 -48.29 84.67 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 124.218 1.007 . . . . 0.0 110.507 177.328 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.52 -36.97 85.54 Favored 'General case' 0 CA--C 1.545 0.776 0 N-CA-C 113.465 0.913 . . . . 0.0 113.465 178.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.4 t -64.55 -40.14 88.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 121.188 -0.945 . . . . 0.0 111.194 171.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 52.4 t30 -63.48 -47.66 80.86 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 118.774 0.715 . . . . 0.0 112.58 175.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.7 p -69.54 -29.51 67.12 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.41 0.893 . . . . 0.0 113.41 -175.408 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 11.1 t -62.61 -18.81 62.94 Favored 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.526 1.306 . . . . 0.0 114.526 176.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 59.2 mtmt -60.29 -16.55 35.37 Favored 'General case' 0 N--CA 1.482 1.169 0 N-CA-C 113.828 1.047 . . . . 0.0 113.828 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -123.53 8.17 8.95 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.765 1.626 . . . . 0.0 112.724 -173.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -66.84 155.29 38.7 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.107 1.363 . . . . 0.0 112.74 175.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -133.61 -9.56 2.81 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.681 1.193 . . . . 0.0 113.994 179.492 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 40.4 m -136.87 6.51 2.91 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.205 1.402 . . . . 0.0 113.588 -175.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.4 p90 -160.97 171.84 17.97 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 126.539 1.936 . . . . 0.0 110.576 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.6 mpt_? -141.61 151.21 42.92 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 126.425 1.89 . . . . 0.0 110.451 169.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 62.0 mt -132.7 142.8 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 126.189 1.796 . . . . 0.0 109.6 -179.187 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -144.6 164.47 30.84 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.02 1.728 . . . . 0.0 110.02 169.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 32.6 p -72.0 164.78 25.51 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 120.604 -1.31 . . . . 0.0 112.065 172.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 61.9 t80 -59.27 -39.37 82.66 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 120.943 -1.098 . . . . 0.0 112.095 169.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -63.6 -36.91 85.35 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 123.64 0.776 . . . . 0.0 112.845 176.126 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 28.5 mt-10 -66.23 -47.14 74.8 Favored 'General case' 0 N--CA 1.468 0.431 0 O-C-N 121.424 -0.798 . . . . 0.0 111.854 169.757 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 42.4 t80 -53.26 -43.02 67.08 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 118.687 0.676 . . . . 0.0 112.378 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 24.5 t -54.13 -35.04 28.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.546 1.139 . . . . 0.0 113.195 175.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -90.3 -35.78 7.35 Favored Glycine 0 CA--C 1.538 1.521 0 C-N-CA 123.812 0.72 . . . . 0.0 113.698 179.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -76.1 -1.51 26.37 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.825 1.65 . . . . 0.0 113.921 173.41 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 57.5 tttm -56.57 -31.75 64.51 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 126.886 2.074 . . . . 0.0 115.196 -172.013 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 55.44 -179.27 0.04 OUTLIER 'General case' 0 CA--C 1.553 1.072 0 C-N-CA 126.881 2.073 . . . . 0.0 115.041 179.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -89.88 -7.41 54.3 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 125.573 1.549 . . . . 0.0 114.836 -170.473 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 80.7 -169.4 52.22 Favored Glycine 0 CA--C 1.539 1.577 0 C-N-CA 124.298 0.951 . . . . 0.0 114.076 -177.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 23.2 tptm -144.58 141.22 29.29 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.914 1.685 . . . . 0.0 111.177 -176.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.6 mp0 -68.62 147.97 51.15 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.333 1.453 . . . . 0.0 112.294 178.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 40.8 t -135.51 -26.66 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.318 0 C-N-CA 125.007 1.323 . . . . 0.0 112.599 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -145.96 170.13 17.22 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 126.066 1.746 . . . . 0.0 112.319 -177.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 60.7 p -63.71 -24.09 67.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 115.23 1.567 . . . . 0.0 115.23 -176.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 178.01 171.61 41.59 Favored Glycine 0 CA--C 1.538 1.506 0 C-N-CA 124.622 1.106 . . . . 0.0 113.583 175.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -73.37 -26.65 14.16 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.47 2.78 . . . . 0.0 113.627 -177.434 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 35.5 m 52.34 30.37 7.99 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 126.393 1.877 . . . . 0.0 115.055 -179.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 90.6 p -137.77 3.36 2.48 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 125.403 1.481 . . . . 0.0 114.643 -174.758 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.252 0 C-N-CA 125.451 1.5 . . . . 0.0 112.943 -178.889 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.698 0 C4'-C3'-O3' 114.235 1.398 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.508 0 N-CA-C 111.956 -0.458 . . . . 0.0 111.956 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 7.6 t -150.97 173.24 14.53 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 125.087 1.355 . . . . 0.0 111.984 179.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 20.7 t -60.66 138.45 58.07 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.034 0.934 . . . . 0.0 111.654 174.38 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 86.93 -18.64 34.36 Favored Glycine 0 CA--C 1.538 1.493 0 C-N-CA 124.909 1.243 . . . . 0.0 114.955 -178.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 21.6 m -69.39 -18.6 63.78 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 118.824 1.312 . . . . 0.0 113.808 175.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 56.4 m -144.93 166.45 25.24 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.551 1.941 . . . . 0.0 111.417 -177.174 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -171.83 178.9 43.84 Favored Glycine 0 CA--C 1.536 1.344 0 C-N-CA 124.671 1.129 . . . . 0.0 113.808 178.789 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 173.62 -51.11 0.15 Allowed Glycine 0 CA--C 1.541 1.714 0 CA-C-O 118.42 -1.211 . . . . 0.0 114.594 -178.774 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_exo -56.15 165.22 4.27 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 124.334 3.356 . . . . 0.0 114.939 173.182 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 4.0 p-10 -143.37 161.91 37.11 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.462 1.505 . . . . 0.0 112.667 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 96.9 mt -142.71 169.64 17.19 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 126.7 2.0 . . . . 0.0 111.01 -176.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 80.7 mm-40 -134.95 127.22 18.17 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 125.071 1.348 . . . . 0.0 110.707 178.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -82.9 -17.47 6.96 Favored 'Trans proline' 0 CA--C 1.542 0.914 0 C-N-CA 123.433 2.755 . . . . 0.0 114.05 -179.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 59.4 tttp -65.11 143.96 57.55 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 125.286 1.435 . . . . 0.0 112.381 -176.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 90.1 mmt-85 -135.56 -0.81 2.6 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 125.191 1.396 . . . . 0.0 114.4 178.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -62.36 -23.13 66.63 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.074 0.95 . . . . 0.0 113.492 179.035 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 42.9 p-80 -99.99 12.84 35.84 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 126.834 2.054 . . . . 0.0 113.227 -179.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 38.3 t -118.96 137.28 53.43 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 C-N-CA 124.746 1.218 . . . . 0.0 111.818 -169.807 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 61.3 mt -117.33 166.26 12.51 Favored 'General case' 0 CA--C 1.532 0.256 0 C-N-CA 127.121 2.168 . . . . 0.0 110.762 175.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 14.7 t-80 -124.46 142.33 51.4 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 127.362 2.265 . . . . 0.0 107.935 168.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 9.2 t -134.03 138.29 50.57 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.407 0 C-N-CA 124.638 1.175 . . . . 0.0 109.235 -173.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.3 m -123.09 135.16 54.27 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 124.858 1.263 . . . . 0.0 109.898 -178.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 5.4 p90 -158.7 157.3 28.4 Favored Pre-proline 0 CA--C 1.55 0.978 0 C-N-CA 124.485 1.114 . . . . 0.0 112.512 -170.277 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -56.18 146.03 73.31 Favored 'Trans proline' 0 CA--C 1.539 0.737 0 C-N-CA 123.783 2.989 . . . . 0.0 112.485 168.423 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -58.44 -18.86 31.75 Favored 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.49 1.663 . . . . 0.0 115.49 -177.258 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -64.34 -19.25 65.33 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.724 1.209 . . . . 0.0 113.913 175.003 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 16.3 m95 -67.39 162.46 22.95 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.471 1.108 . . . . 0.0 113.151 175.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 65.8 tttt -143.1 169.92 16.69 Favored 'General case' 0 N--CA 1.467 0.423 0 C-N-CA 127.255 2.222 . . . . 0.0 110.947 178.623 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.2 m -51.45 -30.79 20.84 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 126.292 1.837 . . . . 0.0 112.121 172.239 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 14.4 p -74.76 -43.04 56.94 Favored 'General case' 0 N--CA 1.466 0.364 0 N-CA-C 114.236 1.199 . . . . 0.0 114.236 177.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -61.15 -26.09 67.46 Favored 'General case' 0 CA--C 1.538 0.498 0 O-C-N 121.91 -0.494 . . . . 0.0 110.702 169.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 76.1 mt -78.78 -44.51 23.07 Favored 'General case' 0 CA--C 1.54 0.562 0 C-N-CA 122.772 0.429 . . . . 0.0 111.477 176.403 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -57.14 -37.22 71.71 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 121.029 -1.045 . . . . 0.0 112.143 169.262 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 45.1 tt0 -68.45 -37.75 80.5 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.943 0.897 . . . . 0.0 113.058 175.442 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 59.6 tp -68.36 -28.49 67.17 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.328 1.051 . . . . 0.0 112.975 176.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 68.4 m-85 -117.23 8.74 13.27 Favored 'General case' 0 CA--C 1.548 0.898 0 N-CA-C 114.393 1.257 . . . . 0.0 114.393 -172.01 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 81.8 p -58.14 -27.26 63.61 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -178.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -59.68 -18.23 40.5 Favored 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 125.243 1.417 . . . . 0.0 114.63 178.567 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 37.3 m-85 -94.11 0.58 55.94 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.878 1.271 . . . . 0.0 114.267 -177.098 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 81.97 -45.85 3.39 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.837 1.684 . . . . 0.0 115.182 169.517 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -150.55 133.83 16.27 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.927 1.291 . . . . 0.0 110.78 175.375 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 15.4 pt -143.48 171.93 7.79 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 C-N-CA 125.468 1.507 . . . . 0.0 111.367 -174.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 35.5 mm-40 -138.77 152.14 47.68 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 125.723 1.609 . . . . 0.0 110.302 169.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 76.2 mt -134.08 139.64 47.88 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 C-N-CA 125.082 1.353 . . . . 0.0 109.707 -169.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 7.0 t -144.42 107.24 4.46 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.047 0.939 . . . . 0.0 112.588 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 97.9 m95 -63.23 148.89 46.87 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 113.889 1.07 . . . . 0.0 113.889 -179.543 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 37.0 pt -134.8 -20.93 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.677 0 C-N-CA 124.939 1.296 . . . . 0.0 113.714 171.714 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -153.19 178.77 9.38 Favored 'General case' 0 CA--C 1.543 0.674 0 C-N-CA 124.842 1.257 . . . . 0.0 111.229 173.311 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -66.84 -15.46 63.63 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.59 1.156 . . . . 0.0 112.698 174.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 39.5 p -132.57 8.47 4.22 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.656 1.982 . . . . 0.0 112.976 -173.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 3.7 m -149.34 142.67 25.18 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 124.564 1.146 . . . . 0.0 113.543 -177.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -151.29 160.47 43.79 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.514 1.526 . . . . 0.0 111.377 174.446 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -89.34 154.57 19.98 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 123.808 0.843 . . . . 0.0 110.116 168.425 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 60.9 t -133.8 112.23 16.56 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.497 0 C-N-CA 124.543 1.137 . . . . 0.0 109.164 171.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 37.7 m -85.7 135.11 33.89 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 125.655 1.582 . . . . 0.0 109.945 172.19 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 79.4 mt -118.64 164.01 15.96 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.973 1.309 . . . . 0.0 111.458 -177.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 58.1 m -69.44 -22.36 63.67 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.193 1.183 . . . . 0.0 114.193 -177.31 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -146.75 151.32 42.11 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 125.185 1.394 . . . . 0.0 112.351 -179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -70.19 -19.53 33.95 Favored 'Trans proline' 0 CA--C 1.542 0.918 0 C-N-CA 123.481 2.787 . . . . 0.0 113.303 173.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 26.0 mp0 -64.09 -36.27 83.46 Favored 'General case' 0 N--CA 1.474 0.733 0 O-C-N 120.601 -1.312 . . . . 0.0 111.897 169.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 95.3 mt-30 -68.98 -31.7 70.74 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.061 0.944 . . . . 0.0 112.244 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 86.8 t -57.7 -46.38 86.71 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 C-N-CA 125.09 1.356 . . . . 0.0 110.753 172.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 78.1 mt-30 -63.46 -41.67 98.61 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.263 0.625 . . . . 0.0 112.223 177.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 95.6 mt -62.51 -44.04 98.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 123.925 0.89 . . . . 0.0 111.213 177.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -65.23 -39.45 92.74 Favored 'General case' 0 CA--C 1.545 0.765 0 O-C-N 121.074 -1.016 . . . . 0.0 113.082 178.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 80.6 t -65.54 -40.94 89.65 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.952 0 O-C-N 121.189 -0.944 . . . . 0.0 111.49 174.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 -62.01 -48.11 81.78 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.353 1.061 . . . . 0.0 112.533 174.771 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 25.4 p -73.16 -27.96 61.96 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.025 0.93 . . . . 0.0 113.151 -175.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 13.1 t -64.65 -14.91 60.22 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 114.277 1.214 . . . . 0.0 114.277 171.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 25.1 ttpp -60.75 -14.38 20.9 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.686 1.194 . . . . 0.0 113.431 169.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -114.12 8.26 16.92 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.493 1.917 . . . . 0.0 112.871 179.481 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.66 160.96 21.57 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.857 1.263 . . . . 0.0 113.122 176.797 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -140.66 -7.82 1.1 Allowed 'General case' 0 N--CA 1.48 1.041 0 N-CA-C 115.2 1.555 . . . . 0.0 115.2 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 32.6 m -140.89 8.73 2.12 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.135 1.374 . . . . 0.0 113.631 -178.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 55.6 p90 -160.01 173.89 15.18 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 126.243 1.817 . . . . 0.0 110.841 -176.402 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -147.73 143.47 27.6 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 125.036 1.334 . . . . 0.0 110.826 169.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 71.8 mt -120.35 137.18 54.98 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 126.222 1.809 . . . . 0.0 109.322 179.165 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 25.7 pt20 -147.21 169.06 20.15 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 125.106 1.363 . . . . 0.0 111.293 174.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 43.9 p -71.73 162.66 29.1 Favored 'General case' 0 N--CA 1.478 0.928 0 O-C-N 120.945 -1.097 . . . . 0.0 112.652 176.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -56.28 -37.08 69.36 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 123.605 0.762 . . . . 0.0 112.322 169.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -68.02 -40.0 83.02 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.046 0.938 . . . . 0.0 113.152 176.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 16.6 mm-40 -67.77 -32.83 73.68 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 121.045 -1.034 . . . . 0.0 112.505 174.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 21.2 t80 -63.84 -49.86 71.13 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.064 0.946 . . . . 0.0 111.796 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 8.8 t -53.83 -40.26 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 124.356 1.063 . . . . 0.0 111.954 172.009 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -63.79 -12.36 47.41 Favored Glycine 0 CA--C 1.541 1.708 0 N-CA-C 115.88 1.112 . . . . 0.0 115.88 -178.495 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 18.5 pttp -115.1 -2.74 12.69 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 115.202 1.556 . . . . 0.0 115.202 173.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -54.49 -24.37 20.2 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 125.886 1.674 . . . . 0.0 115.262 -177.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 18.6 pt20 -133.41 20.43 3.98 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.812 1.645 . . . . 0.0 113.055 179.29 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -142.4 66.68 1.33 Allowed 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.596 1.558 . . . . 0.0 110.92 -173.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 164.96 -17.14 0.1 OUTLIER Glycine 0 CA--C 1.537 1.414 0 N-CA-C 116.127 1.211 . . . . 0.0 116.127 177.549 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 35.7 mmtp -53.09 -58.63 6.36 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 125.36 1.464 . . . . 0.0 113.519 -174.127 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 37.2 tp60 -157.49 27.58 0.29 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 125.851 1.66 . . . . 0.0 111.59 175.812 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 34.4 m -60.05 -17.18 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.096 0 N-CA-C 114.779 1.4 . . . . 0.0 114.779 -173.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 81.9 tttt -62.89 -22.99 67.13 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 125.388 1.475 . . . . 0.0 113.772 172.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 77.2 p -126.87 -22.38 3.85 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 114.185 1.18 . . . . 0.0 114.185 174.201 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 101.94 -171.57 21.82 Favored Glycine 0 CA--C 1.54 1.655 0 N-CA-C 116.889 1.516 . . . . 0.0 116.889 167.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_exo -51.81 -26.22 23.4 Favored 'Trans proline' 0 C--N 1.353 0.773 1 C-N-CA 125.604 4.203 . . . . 0.0 116.745 -175.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 72.8 p -62.63 -16.3 56.08 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 114.428 1.27 . . . . 0.0 114.428 174.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 58.2 m -131.64 2.98 4.15 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.805 1.642 . . . . 0.0 113.72 -178.68 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.246 0 CA-C-O 118.193 -1.337 . . . . 0.0 113.261 179.207 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.558 0 C5'-C4'-C3' 111.264 -2.824 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.404 0 N-CA-C 110.878 -0.889 . . . . 0.0 110.878 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 50.3 m -143.8 164.59 30.06 Favored 'General case' 0 N--CA 1.478 0.946 0 C-N-CA 125.226 1.41 . . . . 0.0 112.083 -174.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 12.4 t -149.88 160.33 43.67 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 125.301 1.44 . . . . 0.0 111.418 176.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 138.27 -13.49 3.52 Favored Glycine 0 CA--C 1.538 1.492 0 C-N-CA 125.209 1.385 . . . . 0.0 114.889 178.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 78.3 p -129.56 1.47 5.0 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 125.519 1.528 . . . . 0.0 114.415 -172.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 59.2 p -72.79 -12.39 60.98 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 125.4 1.48 . . . . 0.0 114.326 173.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -78.17 -173.31 41.38 Favored Glycine 0 CA--C 1.538 1.47 0 C-N-CA 125.425 1.488 . . . . 0.0 114.484 177.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -172.83 -172.34 38.4 Favored Glycine 0 CA--C 1.54 1.606 0 C-N-CA 124.881 1.229 . . . . 0.0 113.527 -177.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -75.18 53.34 3.38 Favored 'Trans proline' 0 CA--C 1.549 1.264 1 C-N-CA 125.447 4.098 . . . . 0.0 112.909 -179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -60.54 157.39 14.34 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 125.786 1.634 . . . . 0.0 113.162 178.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 3.6 pp -62.71 164.64 7.49 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.749 1.22 . . . . 0.0 114.268 -178.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 90.6 mt-30 -138.11 91.51 12.99 Favored Pre-proline 0 CA--C 1.547 0.829 0 C-N-CA 125.739 1.616 . . . . 0.0 109.804 -175.432 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -74.15 163.35 36.8 Favored 'Trans proline' 0 CA--C 1.539 0.746 0 C-N-CA 123.151 2.567 . . . . 0.0 112.527 -175.504 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -71.3 26.83 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 126.386 1.874 . . . . 0.0 114.843 175.105 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 78.7 mtm-85 50.35 36.85 13.89 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 126.995 2.118 . . . . 0.0 113.912 -170.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -63.95 -16.36 61.35 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 124.466 1.107 . . . . 0.0 113.521 174.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 47.2 p-80 -89.12 11.0 19.79 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.912 2.085 . . . . 0.0 113.83 172.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 44.1 t -121.96 137.23 56.25 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 125.169 1.388 . . . . 0.0 110.734 -176.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.7 mt -98.73 162.67 12.99 Favored 'General case' 0 N--CA 1.463 0.186 0 C-N-CA 125.871 1.668 . . . . 0.0 111.95 173.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -118.34 138.45 52.4 Favored 'General case' 0 C--N 1.326 -0.433 0 C-N-CA 127.658 2.383 . . . . 0.0 106.287 166.335 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.8 t -136.33 139.98 44.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.59 0 C-N-CA 124.233 1.013 . . . . 0.0 109.417 -169.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 4.7 m -131.24 134.04 46.05 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 125.18 1.392 . . . . 0.0 109.699 -178.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.8 p90 -157.5 158.43 30.65 Favored Pre-proline 0 CA--C 1.547 0.857 0 C-N-CA 124.273 1.029 . . . . 0.0 112.504 -169.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -55.81 144.76 75.67 Favored 'Trans proline' 0 CA--C 1.538 0.692 0 C-N-CA 123.318 2.679 . . . . 0.0 111.923 168.785 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -55.39 -24.4 29.71 Favored 'General case' 0 N--CA 1.481 1.103 0 N-CA-C 115.316 1.598 . . . . 0.0 115.316 -176.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -63.15 -21.21 66.05 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 125.149 1.379 . . . . 0.0 113.782 178.008 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 13.4 m95 -63.69 152.74 38.27 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 124.081 0.953 . . . . 0.0 112.547 174.533 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 43.2 mttm -133.56 171.82 13.57 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 126.211 1.804 . . . . 0.0 111.653 176.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.1 m -50.62 -35.01 28.36 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.341 1.456 . . . . 0.0 112.338 172.13 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.5 m -65.07 -42.4 94.2 Favored 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 113.979 1.103 . . . . 0.0 113.979 175.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -66.12 -31.45 72.32 Favored 'General case' 0 N--CA 1.471 0.616 0 O-C-N 121.623 -0.673 . . . . 0.0 111.246 174.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 78.1 mt -70.91 -44.51 66.07 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 123.884 0.874 . . . . 0.0 111.507 175.178 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -57.28 -41.97 80.77 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 121.24 -0.912 . . . . 0.0 111.938 169.412 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.25 -39.07 92.16 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 118.808 0.731 . . . . 0.0 112.947 176.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 56.0 tp -65.98 -35.05 79.53 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.618 1.167 . . . . 0.0 112.398 179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 72.7 m-85 -111.71 5.83 19.45 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -173.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 24.5 t -53.63 -30.64 43.77 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 125.399 1.479 . . . . 0.0 113.515 173.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.6 -12.15 3.79 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 125.778 1.631 . . . . 0.0 115.129 175.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 54.6 m-85 -113.53 3.08 15.58 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.662 1.585 . . . . 0.0 113.534 -177.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 93.74 -151.62 20.39 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.476 1.036 . . . . 0.0 112.686 -177.727 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 9.4 p-10 -62.28 150.75 38.34 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 123.584 0.754 . . . . 0.0 112.286 170.148 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 27.4 pt -144.76 179.21 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 126.061 1.744 . . . . 0.0 111.245 -174.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -137.95 143.53 40.78 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 124.81 1.244 . . . . 0.0 109.338 168.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.9 mt -127.5 130.99 70.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.789 0 C-N-CA 124.723 1.209 . . . . 0.0 109.456 -171.987 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 63.7 m -137.58 98.94 3.81 Favored 'General case' 0 N--CA 1.467 0.424 0 C-N-CA 125.447 1.499 . . . . 0.0 110.993 -174.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 94.9 m95 -57.94 152.44 16.23 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 124.508 1.123 . . . . 0.0 113.923 179.301 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 36.5 pt -134.05 -22.31 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.588 0 C-N-CA 124.778 1.231 . . . . 0.0 113.401 169.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.2 t0 -154.1 178.2 10.23 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.395 1.078 . . . . 0.0 111.982 174.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -66.23 -14.57 62.14 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.756 1.622 . . . . 0.0 113.189 176.508 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 41.2 p -132.76 8.09 4.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.261 1.824 . . . . 0.0 113.434 -175.528 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 58.0 p -156.75 151.98 26.41 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 114.89 1.441 . . . . 0.0 114.89 179.006 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.84 162.08 41.52 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 125.656 1.582 . . . . 0.0 112.051 -177.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -94.61 150.58 20.09 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.13 0.972 . . . . 0.0 110.124 167.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 47.5 t -138.99 113.79 8.06 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.318 1.047 . . . . 0.0 110.848 177.476 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 50.9 m -76.48 136.22 39.37 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.963 1.305 . . . . 0.0 111.466 174.72 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 74.0 mt -118.57 163.92 16.07 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.582 1.553 . . . . 0.0 110.236 173.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 50.9 m -69.6 -23.45 63.52 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.391 1.256 . . . . 0.0 114.391 -174.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 21.7 mt-30 -148.19 146.39 23.13 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 124.752 1.221 . . . . 0.0 112.959 -176.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 50.8 Cg_exo -55.69 -29.99 73.49 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 123.786 2.99 . . . . 0.0 114.177 168.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.0 mp0 -60.89 -37.21 81.4 Favored 'General case' 0 CA--C 1.542 0.649 0 O-C-N 120.944 -1.097 . . . . 0.0 112.073 174.191 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -70.19 -36.38 74.58 Favored 'General case' 0 CA--C 1.539 0.543 0 O-C-N 121.379 -0.826 . . . . 0.0 111.62 175.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 15.1 t -58.86 -47.84 88.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.708 0.803 . . . . 0.0 111.223 170.255 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -59.72 -41.33 90.6 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 118.519 0.599 . . . . 0.0 112.255 177.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 82.8 mt -62.56 -50.55 79.35 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.7 0 C-N-CA 123.479 0.712 . . . . 0.0 110.983 174.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.92 -36.28 82.85 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 62.6 t -65.35 -41.0 90.23 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 O-C-N 121.386 -0.821 . . . . 0.0 111.048 171.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 55.9 t30 -64.1 -45.63 87.77 Favored 'General case' 0 CA--C 1.543 0.708 0 CA-C-N 119.14 0.882 . . . . 0.0 112.814 175.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 49.1 p -72.09 -22.07 61.4 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -176.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 25.1 p -60.14 -17.33 39.67 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 114.693 1.368 . . . . 0.0 114.693 175.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -52.82 -22.97 6.02 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.506 1.922 . . . . 0.0 113.717 169.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 61.2 m-85 -123.9 20.51 9.2 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 125.993 1.717 . . . . 0.0 112.715 -175.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -63.79 -37.75 88.55 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 115.054 1.502 . . . . 0.0 115.054 -176.297 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 52.91 -20.68 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 130.014 3.326 . . . . 0.0 118.819 -176.274 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 51.1 m -136.2 3.63 2.88 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 125.4 1.48 . . . . 0.0 114.027 -173.3 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 51.4 p90 -156.42 177.72 11.14 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 127.103 2.161 . . . . 0.0 109.85 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 3.3 tpt180 -143.76 150.22 38.27 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 124.929 1.292 . . . . 0.0 111.022 175.582 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 92.0 mt -129.52 145.37 35.82 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 125.554 1.542 . . . . 0.0 110.079 179.713 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -141.16 170.19 16.19 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.799 2.44 . . . . 0.0 108.731 172.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 31.9 p -79.29 163.92 24.53 Favored 'General case' 0 N--CA 1.479 0.98 0 O-C-N 120.495 -1.378 . . . . 0.0 110.069 167.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 67.2 t80 -55.95 -43.32 77.35 Favored 'General case' 0 CA--C 1.542 0.648 0 O-C-N 121.378 -0.826 . . . . 0.0 111.678 169.214 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -67.85 -38.88 83.7 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 113.273 0.842 . . . . 0.0 113.273 -179.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 13.0 tp10 -62.64 -38.97 92.36 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.534 1.534 . . . . 0.0 111.769 176.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 93.2 t80 -67.88 -50.8 54.3 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 123.318 0.647 . . . . 0.0 112.436 170.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 6.2 t -51.6 -41.5 28.08 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.066 0 C-N-CA 124.885 1.274 . . . . 0.0 113.186 -177.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -64.93 -11.49 50.99 Favored Glycine 0 CA--C 1.542 1.758 0 N-CA-C 115.47 0.948 . . . . 0.0 115.47 -178.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.1 ptpp? -137.35 11.82 3.01 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.45 1.9 . . . . 0.0 114.576 -178.863 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -49.85 -17.16 0.33 Allowed 'General case' 0 N--CA 1.482 1.156 0 N-CA-C 118.354 2.724 . . . . 0.0 118.354 -169.356 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -60.19 -22.69 63.26 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.442 1.097 . . . . 0.0 112.666 168.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 64.0 pttt -140.42 -177.93 5.26 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 127.775 2.43 . . . . 0.0 111.102 176.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 179.7 177.96 48.18 Favored Glycine 0 CA--C 1.532 1.117 0 O-C-N 121.597 -0.689 . . . . 0.0 113.975 177.169 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? -61.53 151.2 33.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 124.94 1.296 . . . . 0.0 111.578 174.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 8.4 tp-100 -148.78 151.27 34.51 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.959 1.703 . . . . 0.0 109.442 171.342 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.5 m -132.95 -7.93 1.48 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 114.606 1.336 . . . . 0.0 114.606 -169.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -64.6 -10.86 29.38 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 115.019 1.489 . . . . 0.0 115.019 173.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 13.3 m -70.6 17.34 0.07 Allowed 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 127.993 2.517 . . . . 0.0 116.321 -171.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . -159.46 174.7 36.37 Favored Glycine 0 CA--C 1.539 1.593 0 O-C-N 120.843 -1.161 . . . . 0.0 114.122 -179.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 77.7 Cg_endo -72.74 164.76 34.67 Favored 'Trans proline' 0 CA--C 1.541 0.846 0 C-N-CA 124.137 3.225 . . . . 0.0 113.414 -175.598 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 42.8 m -134.13 9.91 3.83 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.492 1.517 . . . . 0.0 113.434 -177.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 54.8 p -71.39 -15.48 62.37 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 125.376 1.47 . . . . 0.0 114.947 -178.602 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.196 0 C-N-CA 125.523 1.535 . . . . 0.0 112.722 178.75 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.422 -2.612 0 C5'-C4'-O4' 112.885 2.632 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.472 1.051 0 N-CA-C 110.925 -0.87 . . . . 0.0 110.925 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 67.4 m -143.95 157.8 44.11 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.559 1.544 . . . . 0.0 111.772 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 34.3 m -137.65 6.5 2.72 Favored 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 114.429 1.27 . . . . 0.0 114.429 -171.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 177.92 -177.3 48.34 Favored Glycine 0 CA--C 1.535 1.324 0 C-N-CA 124.379 0.99 . . . . 0.0 114.007 -178.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 80.3 p -137.18 4.67 2.72 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.539 1.536 . . . . 0.0 114.368 -174.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 8.5 t -153.14 173.34 15.62 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.018 1.727 . . . . 0.0 111.083 178.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -170.52 174.81 44.5 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.263 0.935 . . . . 0.0 114.677 -179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 173.21 -175.99 45.99 Favored Glycine 0 CA--C 1.54 1.623 0 C-N-CA 125.859 1.695 . . . . 0.0 112.219 -177.023 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -66.31 -12.94 37.72 Favored 'Trans proline' 0 CA--C 1.542 0.882 0 C-N-CA 123.652 2.901 . . . . 0.0 114.422 -178.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -70.43 -5.03 25.49 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 125.545 1.538 . . . . 0.0 114.347 171.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 92.1 mt -130.93 125.13 32.67 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 126.856 2.062 . . . . 0.0 109.438 178.213 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 80.6 mt-30 -137.36 74.73 47.31 Favored Pre-proline 0 CA--C 1.545 0.787 0 C-N-CA 124.612 1.165 . . . . 0.0 110.906 -168.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -71.53 169.15 21.66 Favored 'Trans proline' 0 CA--C 1.543 0.94 0 C-N-CA 124.094 3.196 . . . . 0.0 113.355 -178.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 8.8 mptt -134.76 171.88 13.74 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 126.667 1.987 . . . . 0.0 111.231 -178.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 5.2 mmp_? -124.34 -4.92 7.79 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 126.302 1.841 . . . . 0.0 113.771 176.062 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -65.73 -21.91 66.56 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 124.238 1.015 . . . . 0.0 113.684 -176.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 57.2 p-80 -95.0 12.99 26.49 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.425 1.89 . . . . 0.0 113.672 176.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 38.2 t -116.98 134.12 61.56 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 C-N-CA 124.422 1.089 . . . . 0.0 111.362 -170.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 89.8 mt -102.2 164.96 11.4 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.593 1.957 . . . . 0.0 111.24 174.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 30.5 t-80 -124.05 138.04 54.5 Favored 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 127.196 2.198 . . . . 0.0 107.34 167.657 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 6.2 t -135.42 138.49 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.479 0 C-N-CA 124.695 1.198 . . . . 0.0 109.387 -169.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 10.1 m -127.05 136.03 51.63 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 125.221 1.408 . . . . 0.0 109.501 -177.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 3.2 p90 -159.91 158.93 27.3 Favored Pre-proline 0 CA--C 1.549 0.922 0 C-N-CA 124.128 0.971 . . . . 0.0 113.131 -168.901 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -58.02 146.42 87.48 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 123.464 2.776 . . . . 0.0 111.346 167.241 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -57.62 -21.29 38.47 Favored 'General case' 0 N--CA 1.482 1.144 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -175.861 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 23.5 tt0 -62.44 -22.47 66.22 Favored 'General case' 0 CA--C 1.546 0.811 0 C-N-CA 125.697 1.599 . . . . 0.0 113.985 174.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 11.0 m95 -62.96 148.91 46.14 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 122.07 0.938 . . . . 0.0 113.068 173.586 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 25.4 mtmm -132.73 166.19 22.78 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 126.457 1.903 . . . . 0.0 111.377 -172.873 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 6.5 m -52.75 -33.68 49.34 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.406 1.083 . . . . 0.0 111.837 169.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 75.5 m -66.61 -45.88 77.69 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 124.492 1.117 . . . . 0.0 113.912 173.081 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 49.5 m-20 -63.54 -34.49 77.91 Favored 'General case' 0 N--CA 1.474 0.766 0 O-C-N 121.508 -0.745 . . . . 0.0 111.079 175.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 77.3 mt -67.42 -43.86 80.18 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 124.251 1.02 . . . . 0.0 111.278 173.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -58.48 -42.09 86.72 Favored 'General case' 0 CA--C 1.537 0.456 0 O-C-N 121.112 -0.993 . . . . 0.0 112.507 170.67 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -64.97 -30.53 71.53 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 119.168 0.894 . . . . 0.0 113.191 175.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 51.6 tp -74.51 -29.88 61.58 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 124.554 1.142 . . . . 0.0 113.262 175.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 73.4 m-85 -122.01 -4.34 9.05 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -169.811 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 83.0 p -57.96 -23.27 53.0 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 120.064 1.302 . . . . 0.0 114.256 174.053 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.13 -14.63 7.25 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.64 1.576 . . . . 0.0 114.345 171.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 40.1 m-85 -109.86 3.07 20.29 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.888 1.675 . . . . 0.0 113.309 -179.883 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 101.87 -158.53 18.43 Favored Glycine 0 CA--C 1.533 1.2 0 C-N-CA 124.822 1.201 . . . . 0.0 112.801 -176.6 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -63.53 152.89 37.33 Favored 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 123.428 0.691 . . . . 0.0 112.199 170.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 31.4 pt -143.93 174.64 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.826 0 C-N-CA 125.485 1.514 . . . . 0.0 111.659 -173.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 3.2 mm-40 -137.24 151.57 48.88 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 125.433 1.493 . . . . 0.0 110.177 168.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 71.5 mt -136.17 131.19 48.88 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 C-N-CA 124.479 1.112 . . . . 0.0 110.303 -169.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 51.7 m -137.54 103.73 5.13 Favored 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.131 1.772 . . . . 0.0 109.763 -177.119 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 61.4 m95 -75.32 160.44 30.32 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.54 -0.725 . . . . 0.0 112.852 -174.085 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 29.9 pt -135.48 -18.94 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.807 1.243 . . . . 0.0 113.677 175.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.5 t0 -151.65 179.05 8.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.651 1.18 . . . . 0.0 111.737 172.733 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 26.2 t0 -69.23 -10.8 59.48 Favored 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 125.563 1.545 . . . . 0.0 113.05 170.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 39.9 p -135.43 3.34 3.06 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 125.839 1.656 . . . . 0.0 113.929 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 89.1 p -155.15 155.37 33.83 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 114.454 1.279 . . . . 0.0 114.454 170.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -154.15 160.37 41.86 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 125.195 1.398 . . . . 0.0 112.473 -176.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 57.5 m-85 -91.76 148.88 21.92 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 123.907 0.883 . . . . 0.0 110.675 168.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 48.8 t -136.42 111.78 11.38 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.753 0 C-N-CA 124.808 1.243 . . . . 0.0 110.28 178.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 69.8 m -79.07 115.57 18.83 Favored 'General case' 0 N--CA 1.466 0.355 0 C-N-CA 125.666 1.586 . . . . 0.0 110.575 173.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 65.7 mt -82.73 163.61 21.19 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.384 0.673 . . . . 0.0 111.02 169.48 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 87.5 p -67.47 -21.57 65.52 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 176.608 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -147.76 145.03 20.03 Favored Pre-proline 0 CA--C 1.545 0.751 0 C-N-CA 125.445 1.498 . . . . 0.0 111.691 -177.528 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 97.4 Cg_endo -71.54 -18.07 29.59 Favored 'Trans proline' 0 CA--C 1.539 0.762 0 C-N-CA 123.411 2.741 . . . . 0.0 113.372 172.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.8 mm-40 -62.45 -26.9 68.76 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 121.043 -1.036 . . . . 0.0 112.789 172.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -92.97 -17.62 23.71 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 124.546 1.138 . . . . 0.0 113.012 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 28.9 t -57.39 -45.28 85.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.959 0 C-N-CA 124.748 1.219 . . . . 0.0 110.973 171.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 22.6 tp60 -61.73 -34.59 76.09 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.47 0.708 . . . . 0.0 112.753 177.218 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 47.6 mt -68.23 -46.09 81.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.678 0 C-N-CA 123.613 0.765 . . . . 0.0 110.367 178.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.73 -40.67 97.91 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 121.432 -0.792 . . . . 0.0 112.725 176.051 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 73.1 t -67.98 -32.31 55.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 C-N-CA 124.014 0.926 . . . . 0.0 112.441 175.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 28.5 t-20 -68.96 -47.91 64.47 Favored 'General case' 0 CA--C 1.544 0.746 0 O-C-N 121.099 -1.001 . . . . 0.0 112.07 171.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 24.3 p -76.23 -22.81 54.77 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.327 1.232 . . . . 0.0 114.327 -172.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 55.8 p -61.17 -18.23 57.07 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 175.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 57.8 tptt -55.59 -19.84 11.59 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.015 1.726 . . . . 0.0 113.601 169.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 40.1 m-85 -122.99 18.76 10.09 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 126.14 1.776 . . . . 0.0 112.671 -175.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -60.62 162.94 5.9 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 125.522 1.529 . . . . 0.0 113.913 176.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -129.74 -15.21 3.96 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 114.971 1.471 . . . . 0.0 114.971 -171.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 14.9 t -154.95 10.93 0.35 Allowed 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 125.034 1.334 . . . . 0.0 112.75 -176.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 54.2 p90 -158.07 175.39 13.86 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 125.124 1.37 . . . . 0.0 111.913 -169.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 71.2 ttt180 -145.6 152.44 39.68 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.961 1.704 . . . . 0.0 110.402 169.754 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 42.2 mt -136.17 142.71 37.93 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 C-N-CA 125.44 1.496 . . . . 0.0 110.317 -174.409 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -146.9 169.13 19.79 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.852 2.061 . . . . 0.0 109.808 169.624 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 16.8 p -71.8 164.63 25.65 Favored 'General case' 0 N--CA 1.484 1.254 0 O-C-N 120.038 -1.664 . . . . 0.0 112.404 171.758 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -56.28 -42.25 77.18 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 121.105 -0.997 . . . . 0.0 111.856 169.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.48 -38.39 87.19 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 123.687 0.795 . . . . 0.0 112.94 177.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 50.3 mt-10 -64.37 -41.37 96.73 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.352 -0.843 . . . . 0.0 111.965 172.643 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 66.1 t80 -58.61 -49.59 76.93 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 118.973 0.806 . . . . 0.0 111.677 172.72 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 37.6 t -56.52 -44.29 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 C-N-CA 124.071 0.949 . . . . 0.0 111.934 176.378 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -75.19 -9.29 84.11 Favored Glycine 0 CA--C 1.54 1.599 0 C-N-CA 124.275 0.94 . . . . 0.0 115.383 -178.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -125.71 10.48 7.76 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 126.533 1.933 . . . . 0.0 113.16 -177.444 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 78.9 tttt -62.1 -19.47 63.02 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 126.532 1.933 . . . . 0.0 114.837 -173.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 29.5 mp0 -56.74 138.45 52.97 Favored 'General case' 0 CA--C 1.544 0.714 0 C-N-CA 125.686 1.595 . . . . 0.0 112.297 179.197 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -65.2 128.42 35.74 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.255 1.022 . . . . 0.0 111.311 177.255 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 169.17 50.79 0.03 OUTLIER Glycine 0 CA--C 1.534 1.22 0 C-N-CA 123.906 0.765 . . . . 0.0 113.408 -173.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -138.18 167.2 22.33 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 125.47 1.508 . . . . 0.0 113.196 -171.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 50.2 tp60 -148.59 151.16 34.56 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 126.074 1.75 . . . . 0.0 110.374 -179.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 35.0 m -72.82 1.84 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.3 0 N-CA-C 115.178 1.548 . . . . 0.0 115.178 -177.685 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -53.67 137.66 36.79 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.892 1.677 . . . . 0.0 112.409 -179.614 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 8.7 t -152.57 173.58 15.0 Favored 'General case' 0 N--CA 1.472 0.654 0 C-N-CA 125.403 1.481 . . . . 0.0 111.753 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 175.16 -49.02 0.13 Allowed Glycine 0 CA--C 1.54 1.612 0 C-N-CA 125.006 1.288 . . . . 0.0 114.88 -179.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 77.2 Cg_exo -59.59 -24.36 74.87 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.925 3.083 . . . . 0.0 116.156 179.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 50.3 m -60.19 148.15 37.32 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.826 1.25 . . . . 0.0 113.342 -179.259 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 52.3 m -83.09 -0.4 48.92 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 114.456 1.28 . . . . 0.0 114.456 -175.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.236 0 C-N-CA 125.94 1.733 . . . . 0.0 113.391 179.715 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . 0.493 ' H81' " O4'" ' A' ' 524' ' ' GDP . . . . . . . . 0 O4'--C4' 1.421 -2.68 0 C5'-C4'-O4' 112.533 2.381 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . 0.493 " O4'" ' H81' ' A' ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.551 0 N-CA-C 110.773 -0.931 . . . . 0.0 110.773 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 56.4 p -53.51 -25.41 16.56 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 125.262 1.425 . . . . 0.0 114.288 176.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 33.2 p -53.79 -15.29 1.21 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 127.195 2.198 . . . . 0.0 115.355 169.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . -149.78 23.86 1.17 Allowed Glycine 0 CA--C 1.537 1.463 0 C-N-CA 125.193 1.377 . . . . 0.0 114.919 177.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 76.7 p -141.33 -0.05 1.46 Allowed 'General case' 0 N--CA 1.48 1.059 0 N-CA-C 115.917 1.821 . . . . 0.0 115.917 -177.736 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 95.7 p -146.24 170.2 17.23 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 124.241 1.016 . . . . 0.0 113.401 178.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . -175.64 -169.92 37.88 Favored Glycine 0 CA--C 1.537 1.429 0 C-N-CA 125.625 1.583 . . . . 0.0 112.838 -175.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . -169.36 -175.64 38.72 Favored Glycine 0 CA--C 1.543 1.783 0 C-N-CA 124.012 0.815 . . . . 0.0 114.705 -179.023 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 68.5 Cg_exo -52.99 163.94 1.87 Allowed 'Trans proline' 0 CA--C 1.542 0.921 0 C-N-CA 125.227 3.951 . . . . 0.0 115.549 177.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 36.3 t0 -145.41 163.98 32.93 Favored 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.268 1.427 . . . . 0.0 111.979 179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 85.0 mt -69.75 178.08 2.75 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.265 1.826 . . . . 0.0 113.472 -179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 52.87 58.44 14.4 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 126.747 2.019 . . . . 0.0 115.136 176.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -66.31 166.29 21.86 Favored 'Trans proline' 0 CA--C 1.545 1.027 0 C-N-CA 123.205 2.604 . . . . 0.0 112.325 171.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 37.8 tttm -130.72 27.25 4.97 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 125.149 1.379 . . . . 0.0 113.507 -170.272 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 36.0 mmt180 -126.88 2.88 6.63 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 126.107 1.763 . . . . 0.0 114.168 -178.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -64.33 -12.72 44.86 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.082 1.353 . . . . 0.0 114.298 -178.394 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 47.9 p-80 -115.28 13.46 16.67 Favored 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 127.187 2.195 . . . . 0.0 113.062 178.926 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 54.7 t -114.24 125.02 71.45 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 124.606 1.162 . . . . 0.0 111.153 -170.549 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 92.6 mt -92.23 164.11 13.67 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 125.374 1.47 . . . . 0.0 111.79 170.372 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 37.6 t-80 -122.41 134.76 54.6 Favored 'General case' 0 C--N 1.327 -0.374 0 C-N-CA 127.19 2.196 . . . . 0.0 106.663 166.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 3.8 t -130.18 136.36 58.87 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.47 0 C-N-CA 125.111 1.364 . . . . 0.0 109.022 -169.344 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 11.6 m -129.66 135.57 48.68 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.081 1.353 . . . . 0.0 109.422 -178.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 2.8 p90 -158.9 158.38 29.04 Favored Pre-proline 0 CA--C 1.545 0.779 0 C-N-CA 123.904 0.881 . . . . 0.0 112.788 -169.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 46.0 Cg_exo -56.46 143.23 88.09 Favored 'Trans proline' 0 CA--C 1.537 0.647 0 C-N-CA 122.976 2.451 . . . . 0.0 110.82 166.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 4.4 ptmt -58.13 -19.45 32.64 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 115.577 1.695 . . . . 0.0 115.577 -176.171 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 22.5 mm-40 -61.52 -21.37 64.17 Favored 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 125.171 1.388 . . . . 0.0 113.946 174.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -64.02 151.1 43.83 Favored 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 123.801 0.84 . . . . 0.0 112.541 172.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -136.64 167.66 20.99 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 126.044 1.738 . . . . 0.0 111.568 179.055 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 1.9 m -51.62 -36.38 45.68 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.242 1.417 . . . . 0.0 112.817 177.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 72.5 m -67.63 -39.12 84.67 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 114.04 1.126 . . . . 0.0 114.04 176.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 41.9 m-20 -67.38 -31.7 72.11 Favored 'General case' 0 N--CA 1.471 0.621 0 O-C-N 121.319 -0.863 . . . . 0.0 110.965 173.63 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 82.3 mt -71.18 -46.24 61.77 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 124.068 0.947 . . . . 0.0 111.223 176.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 27.3 m-85 -57.16 -37.87 72.72 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 121.029 -1.044 . . . . 0.0 112.846 171.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 36.3 mt-30 -69.72 -37.41 76.54 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.092 0.957 . . . . 0.0 113.31 174.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 66.2 tp -62.83 -34.25 76.93 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.559 1.143 . . . . 0.0 112.233 176.691 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 65.1 m-85 -105.23 5.95 32.53 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 114.306 1.224 . . . . 0.0 114.306 -176.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 21.4 t -54.93 -29.27 55.93 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.908 1.283 . . . . 0.0 113.406 176.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.82 -13.02 5.09 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.81 1.644 . . . . 0.0 115.21 173.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 40.5 m-85 -117.61 5.74 12.41 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.702 1.601 . . . . 0.0 113.168 -179.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 78.19 -148.47 32.9 Favored Glycine 0 CA--C 1.535 1.314 0 O-C-N 121.291 -0.88 . . . . 0.0 112.992 -177.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 57.6 t30 -59.67 142.5 52.88 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.218 1.007 . . . . 0.0 112.678 177.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 10.2 pt -143.59 177.86 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.91 0 C-N-CA 126.29 1.836 . . . . 0.0 111.287 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -132.57 144.85 50.67 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 124.634 1.174 . . . . 0.0 110.048 169.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 74.1 mt -126.41 131.85 70.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 C-N-CA 125.157 1.383 . . . . 0.0 109.044 -172.031 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 56.8 m -134.92 96.43 3.52 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 125.799 1.64 . . . . 0.0 110.755 -176.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 90.2 m95 -57.46 150.03 19.59 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 124.256 1.022 . . . . 0.0 113.209 177.326 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 38.1 pt -133.16 -19.13 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.686 0 C-N-CA 124.658 1.183 . . . . 0.0 113.237 170.117 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -152.06 170.87 18.87 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 125.247 1.419 . . . . 0.0 111.785 176.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -61.46 -17.52 54.83 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.16 1.784 . . . . 0.0 113.097 170.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 72.8 p -130.04 4.1 4.86 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 125.979 1.712 . . . . 0.0 114.69 -176.631 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 98.7 p -154.74 157.09 37.5 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.341 1.608 . . . . 0.0 115.341 174.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -152.69 163.18 40.16 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.771 1.629 . . . . 0.0 112.207 -177.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 49.5 m-85 -98.26 151.36 20.56 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 124.425 1.09 . . . . 0.0 110.18 167.818 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 89.6 t -139.32 117.85 12.39 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.819 0 C-N-CA 124.05 0.94 . . . . 0.0 111.088 179.793 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 73.2 m -83.16 116.29 22.29 Favored 'General case' 0 N--CA 1.469 0.482 0 C-N-CA 125.55 1.54 . . . . 0.0 110.581 173.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 64.0 mt -85.65 160.4 19.59 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 124.169 0.987 . . . . 0.0 111.649 173.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 93.7 p -73.01 -19.83 61.12 Favored 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.458 1.281 . . . . 0.0 114.458 -176.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -142.27 149.14 50.59 Favored Pre-proline 0 CA--C 1.545 0.752 0 C-N-CA 125.48 1.512 . . . . 0.0 110.925 174.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 68.0 Cg_endo -70.25 -23.71 28.26 Favored 'Trans proline' 0 CA--C 1.539 0.748 0 C-N-CA 122.943 2.428 . . . . 0.0 113.645 179.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -63.68 -30.05 71.2 Favored 'General case' 0 N--CA 1.476 0.861 0 O-C-N 120.944 -1.097 . . . . 0.0 112.679 175.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 74.4 mt-30 -69.56 -24.44 63.7 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.09 1.356 . . . . 0.0 112.685 -178.883 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 47.8 t -59.69 -47.46 91.09 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.78 0 C-N-CA 124.398 1.079 . . . . 0.0 110.987 177.001 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 60.4 tp60 -62.13 -37.94 87.06 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 123.103 0.561 . . . . 0.0 112.068 177.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 68.0 mt -62.04 -54.72 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 123.732 0.813 . . . . 0.0 110.143 176.499 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -63.26 -37.15 86.13 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -178.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 65.0 t -63.8 -45.09 98.12 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.79 0 O-C-N 121.239 -0.913 . . . . 0.0 110.922 172.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 54.7 t30 -61.73 -45.93 91.81 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.72 0.808 . . . . 0.0 112.93 178.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 40.9 p -70.17 -22.78 62.93 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.269 1.028 . . . . 0.0 113.513 -177.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 47.5 m -90.0 -6.56 55.47 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.862 1.43 . . . . 0.0 114.862 -177.258 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 56.3 mtmt -56.41 -16.4 5.7 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 114.322 1.23 . . . . 0.0 114.322 172.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 16.4 m-85 -126.49 9.93 7.22 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 125.967 1.707 . . . . 0.0 113.035 -173.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -65.4 156.16 33.14 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 124.801 1.241 . . . . 0.0 112.795 177.358 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -131.28 -6.74 3.81 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 114.561 1.319 . . . . 0.0 114.561 -173.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 43.0 m -132.3 1.78 3.83 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 125.204 1.402 . . . . 0.0 113.511 -177.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 45.8 p90 -163.02 174.39 12.35 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 127.812 2.445 . . . . 0.0 109.621 178.629 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 56.1 ttp180 -147.6 148.21 30.88 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.567 1.547 . . . . 0.0 110.868 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 74.7 mt -131.7 144.98 35.8 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 125.684 1.593 . . . . 0.0 110.505 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 23.3 pt20 -147.17 170.56 16.97 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 126.933 2.093 . . . . 0.0 109.87 171.329 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 20.9 p -73.5 162.92 28.72 Favored 'General case' 0 N--CA 1.48 1.027 0 O-C-N 120.576 -1.328 . . . . 0.0 111.716 172.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 42.3 t80 -55.1 -41.15 71.24 Favored 'General case' 0 CA--C 1.544 0.729 0 O-C-N 121.409 -0.807 . . . . 0.0 112.156 169.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -70.02 -38.02 75.78 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 113.191 0.812 . . . . 0.0 113.191 179.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -64.38 -41.27 96.78 Favored 'General case' 0 N--CA 1.471 0.61 0 O-C-N 121.413 -0.805 . . . . 0.0 111.698 173.661 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 25.5 t80 -56.11 -50.91 69.73 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.423 0.689 . . . . 0.0 111.791 172.089 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 43.4 t -60.37 -44.31 95.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.019 0 C-N-CA 124.161 0.984 . . . . 0.0 112.355 176.859 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -71.43 -43.09 54.77 Favored Glycine 0 CA--C 1.534 1.262 0 O-C-N 121.725 -0.61 . . . . 0.0 113.454 -174.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -70.59 -22.89 62.51 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.61 1.164 . . . . 0.0 113.475 177.324 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 81.7 tttt -70.32 -10.99 60.57 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 126.447 1.899 . . . . 0.0 114.379 176.139 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -133.47 170.16 15.91 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.848 1.259 . . . . 0.0 113.885 -177.431 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 23.1 tptm -120.81 -34.78 3.49 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 125.421 1.488 . . . . 0.0 114.572 -172.531 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . 135.8 -25.93 3.19 Favored Glycine 0 N--CA 1.478 1.452 0 N-CA-C 116.476 1.35 . . . . 0.0 116.476 169.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -122.11 3.82 9.85 Favored 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 125.006 1.322 . . . . 0.0 113.918 -173.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 61.9 mt-30 -56.97 -22.02 34.98 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.89 1.676 . . . . 0.0 114.124 178.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 27.1 m -66.98 -18.52 24.36 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 125.965 1.706 . . . . 0.0 114.448 174.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 67.9 tttt -143.33 1.79 1.24 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -174.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 67.1 p -62.98 -20.31 65.15 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.039 1.496 . . . . 0.0 115.039 -179.678 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 177.08 179.35 47.4 Favored Glycine 0 CA--C 1.541 1.691 0 C-N-CA 124.846 1.212 . . . . 0.0 113.877 174.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -57.32 -21.85 46.42 Favored 'Trans proline' 0 CA--C 1.543 0.943 0 C-N-CA 124.59 3.527 . . . . 0.0 115.627 176.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 13.2 t -149.49 171.99 15.71 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 126.095 1.758 . . . . 0.0 111.222 179.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 20.9 m -128.32 5.17 5.74 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.747 1.619 . . . . 0.0 113.724 -172.348 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.303 0 C-N-CA 125.493 1.52 . . . . 0.0 113.781 177.226 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . 0 O4'--C4' 1.421 -2.705 0 C5'-C4'-O4' 113.919 3.371 . 0.0 '__' . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 423' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.522 0 N-CA-C 111.302 -0.719 . . . . 0.0 111.302 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 424' ' ' SER . . . . . . . . . . . . . 10.5 t -151.96 164.56 36.9 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.196 1.398 . . . . 0.0 111.472 178.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 425' ' ' SER . . . . . . . . . . . . . 28.0 m -137.38 -1.8 2.07 Favored 'General case' 0 N--CA 1.477 0.923 0 C-N-CA 125.122 1.369 . . . . 0.0 114.309 -174.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 426' ' ' GLY . . . . . . . . . . . . . . . 164.1 177.1 36.57 Favored Glycine 0 CA--C 1.535 1.344 0 C-N-CA 124.275 0.94 . . . . 0.0 114.088 179.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 427' ' ' SER . . . . . . . . . . . . . 80.4 p -141.28 -0.17 1.45 Allowed 'General case' 0 N--CA 1.479 1.016 0 N-CA-C 114.583 1.327 . . . . 0.0 114.583 -177.291 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 428' ' ' SER . . . . . . . . . . . . . 60.0 p -70.47 165.28 22.91 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 125.117 1.367 . . . . 0.0 113.282 175.045 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 429' ' ' GLY . . . . . . . . . . . . . . . 166.18 -29.2 0.19 Allowed Glycine 0 CA--C 1.537 1.413 0 C-N-CA 124.153 0.883 . . . . 0.0 114.635 175.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 430' ' ' GLY . . . . . . . . . . . . . . . 178.77 175.52 45.89 Favored Glycine 0 CA--C 1.539 1.542 0 C-N-CA 124.822 1.201 . . . . 0.0 113.405 176.302 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 431' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -72.34 -18.73 26.21 Favored 'Trans proline' 0 CA--C 1.541 0.869 0 C-N-CA 123.794 2.996 . . . . 0.0 113.67 -179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 432' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -149.37 133.61 17.34 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 125.863 1.665 . . . . 0.0 110.39 175.531 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 433' ' ' LEU . . . . . . . . . . . . . 96.1 mt -145.37 172.1 13.67 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 126.729 2.011 . . . . 0.0 110.397 -176.27 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 434' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -142.57 151.44 57.41 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 124.227 1.011 . . . . 0.0 112.878 176.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 435' ' ' PRO . . . . . . . . . . . . . 40.4 Cg_exo -59.14 163.78 11.43 Favored 'Trans proline' 0 CA--C 1.541 0.868 0 C-N-CA 123.861 3.041 . . . . 0.0 114.402 169.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 436' ' ' LYS . . . . . . . . . . . . . 30.4 mtpp -135.46 24.51 3.46 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 126.54 1.936 . . . . 0.0 111.949 170.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 437' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -133.34 29.33 3.98 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 127.179 2.191 . . . . 0.0 112.699 -169.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 438' ' ' ASP . . . . . . . . . . . . . 10.8 m-20 -59.74 -22.23 61.79 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.69 1.196 . . . . 0.0 113.782 176.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 439' ' ' HIS . . . . . . . . . . . . . 49.3 p-80 -82.53 7.54 14.2 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 126.545 1.938 . . . . 0.0 114.285 173.786 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 440' ' ' VAL . . . . . . . . . . . . . 19.6 t -123.39 140.79 45.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.842 0 C-N-CA 125.064 1.345 . . . . 0.0 111.509 -170.704 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 441' ' ' LEU . . . . . . . . . . . . . 82.2 mt -115.43 164.69 13.92 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 127.573 2.349 . . . . 0.0 110.499 176.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 442' ' ' HIS . . . . . . . . . . . . . 31.5 t-80 -122.88 140.86 52.52 Favored 'General case' 0 C--N 1.328 -0.35 0 C-N-CA 126.556 1.942 . . . . 0.0 108.246 168.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 443' ' ' VAL . . . . . . . . . . . . . 5.5 t -133.47 138.16 51.59 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 C-N-CA 124.772 1.229 . . . . 0.0 109.202 -170.445 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 444' ' ' THR . . . . . . . . . . . . . 12.1 m -128.19 137.91 52.25 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.142 1.377 . . . . 0.0 109.511 -179.537 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 445' ' ' PHE . . . . . . . . . . . . . 4.2 p90 -158.8 158.66 29.38 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 124.184 0.994 . . . . 0.0 112.38 -169.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 446' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_exo -54.98 142.51 76.11 Favored 'Trans proline' 0 CA--C 1.538 0.722 0 C-N-CA 123.258 2.639 . . . . 0.0 111.89 168.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 447' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -57.0 -21.22 28.99 Favored 'General case' 0 N--CA 1.483 1.178 0 N-CA-C 115.326 1.602 . . . . 0.0 115.326 -177.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 448' ' ' GLU . . . . . . . . . . . . . 44.9 mt-10 -65.61 -20.66 66.4 Favored 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.013 1.325 . . . . 0.0 114.006 174.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 449' ' ' TRP . . . . . . . . . . . . . 12.3 m95 -64.81 151.79 44.47 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.817 0.847 . . . . 0.0 112.194 173.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 450' ' ' LYS . . . . . . . . . . . . . 48.5 mttt -133.26 171.9 13.41 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.902 1.681 . . . . 0.0 112.054 177.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 451' ' ' THR . . . . . . . . . . . . . 3.7 m -50.7 -35.03 29.13 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 125.475 1.51 . . . . 0.0 112.399 174.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 452' ' ' SER . . . . . . . . . . . . . 69.6 m -63.9 -44.76 92.04 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 113.729 1.011 . . . . 0.0 113.729 174.72 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 453' ' ' ASP . . . . . . . . . . . . . 30.7 m-20 -65.48 -31.14 72.05 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.353 0.661 . . . . 0.0 111.391 175.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 454' ' ' LEU . . . . . . . . . . . . . 83.6 mt -72.2 -45.87 58.54 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.804 0.842 . . . . 0.0 111.587 176.313 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 455' ' ' TYR . . . . . . . . . . . . . 4.4 m-85 -59.1 -36.17 74.69 Favored 'General case' 0 N--CA 1.47 0.566 0 O-C-N 121.101 -0.999 . . . . 0.0 112.616 170.189 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 456' ' ' GLN . . . . . . . . . . . . . 25.2 tp60 -68.28 -39.37 82.17 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 118.886 0.766 . . . . 0.0 112.842 174.2 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 457' ' ' LEU . . . . . . . . . . . . . 48.4 tp -65.99 -40.82 91.51 Favored 'General case' 0 N--CA 1.471 0.578 0 C-N-CA 124.713 1.205 . . . . 0.0 112.028 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 458' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -99.62 9.71 42.66 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.022 0.929 . . . . 0.0 113.471 -177.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 459' ' ' SER . . . . . . . . . . . . . 21.7 t -54.84 -31.48 59.52 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 125.459 1.504 . . . . 0.0 113.599 177.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 460' ' ' ALA . . . . . . . . . . . . . . . -58.48 -14.0 6.87 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 125.585 1.554 . . . . 0.0 115.081 176.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 461' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -106.42 0.77 25.11 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.261 1.425 . . . . 0.0 113.767 -177.474 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 462' ' ' GLY . . . . . . . . . . . . . . . 79.86 -47.19 3.26 Favored Glycine 0 CA--C 1.536 1.38 0 C-N-CA 126.097 1.808 . . . . 0.0 115.81 169.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 463' ' ' ASN . . . . . . . . . . . . . 68.2 m-80 -144.07 137.64 27.72 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 125.421 1.489 . . . . 0.0 110.61 -179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 464' ' ' ILE . . . . . . . . . . . . . 22.1 pt -146.5 174.92 2.11 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 C-N-CA 125.386 1.474 . . . . 0.0 111.851 -172.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 465' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -143.8 148.04 35.0 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.942 1.297 . . . . 0.0 109.071 167.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' ILE . . . . . . . . . . . . . 49.8 mt -130.9 136.28 58.4 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.836 0 C-N-CA 124.257 1.023 . . . . 0.0 110.095 -173.205 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 37.5 m -135.13 102.75 5.3 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 125.745 1.618 . . . . 0.0 110.652 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' TRP . . . . . . . . . . . . . 99.7 m95 -59.32 150.47 25.97 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.024 0.93 . . . . 0.0 113.486 176.692 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' ILE . . . . . . . . . . . . . 36.8 pt -135.28 -21.07 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.631 0 C-N-CA 124.632 1.173 . . . . 0.0 113.874 170.789 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -152.27 178.97 8.94 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.684 1.194 . . . . 0.0 112.013 175.541 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -68.27 -14.09 62.73 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.752 1.221 . . . . 0.0 113.234 173.175 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' THR . . . . . . . . . . . . . 40.2 p -132.94 3.52 3.75 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 125.637 1.575 . . . . 0.0 113.769 -172.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' SER . . . . . . . . . . . . . 97.1 p -154.26 155.91 36.07 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 114.869 1.433 . . . . 0.0 114.869 174.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' ALA . . . . . . . . . . . . . . . -153.47 159.51 42.32 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 126.025 1.73 . . . . 0.0 111.61 -178.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' PHE . . . . . . . . . . . . . 58.8 m-85 -89.8 150.16 22.38 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 123.68 0.792 . . . . 0.0 110.28 167.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' VAL . . . . . . . . . . . . . 60.4 t -137.82 121.36 21.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.921 1.288 . . . . 0.0 110.235 177.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' SER . . . . . . . . . . . . . 74.7 m -89.12 142.37 27.7 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.871 1.268 . . . . 0.0 110.929 173.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 82.3 mt -125.54 155.69 40.22 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.441 1.496 . . . . 0.0 110.511 175.202 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' SER . . . . . . . . . . . . . 67.0 m -68.84 -24.26 64.35 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 115.044 1.498 . . . . 0.0 115.044 -171.394 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' GLN . . . . . . . . . . . . . 32.6 mm-40 -144.85 154.7 55.61 Favored Pre-proline 0 N--CA 1.474 0.732 0 C-N-CA 124.875 1.27 . . . . 0.0 112.503 -177.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' PRO . . . . . . . . . . . . . 73.5 Cg_endo -71.07 -21.47 27.43 Favored 'Trans proline' 0 CA--C 1.54 0.814 0 C-N-CA 123.109 2.539 . . . . 0.0 113.007 179.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -62.33 -40.66 97.06 Favored 'General case' 0 CA--C 1.541 0.61 0 O-C-N 121.223 -0.923 . . . . 0.0 111.376 169.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -66.42 -39.9 89.23 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 121.308 -0.87 . . . . 0.0 111.54 177.153 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' VAL . . . . . . . . . . . . . 93.3 t -59.06 -47.76 88.94 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.449 1.1 . . . . 0.0 110.837 171.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' GLN . . . . . . . . . . . . . 21.7 tp60 -62.3 -39.5 93.22 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.516 0.726 . . . . 0.0 112.812 177.344 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' ILE . . . . . . . . . . . . . 70.0 mt -62.84 -46.16 97.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 123.757 0.823 . . . . 0.0 111.02 174.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -62.3 -38.58 89.93 Favored 'General case' 0 CA--C 1.545 0.765 0 CA-C-N 119.117 0.872 . . . . 0.0 112.882 177.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.1 t -66.58 -37.25 79.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 C-N-CA 124.187 0.995 . . . . 0.0 112.088 172.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -71.22 -31.0 67.04 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.23 -0.919 . . . . 0.0 113.281 176.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 490' ' ' THR . . . . . . . . . . . . . 23.9 p -91.58 -18.8 23.5 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -174.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 491' ' ' SER . . . . . . . . . . . . . 67.5 p -67.37 -21.61 65.61 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 179.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 492' ' ' LYS . . . . . . . . . . . . . 46.3 pttt -61.78 -13.06 20.21 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.219 1.563 . . . . 0.0 115.219 178.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 493' ' ' TYR . . . . . . . . . . . . . 1.9 p90 -134.54 27.91 3.67 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.184 1.794 . . . . 0.0 112.729 174.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 494' ' ' ALA . . . . . . . . . . . . . . . -54.95 150.24 10.48 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.26 1.424 . . . . 0.0 113.798 175.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 495' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -72.17 -37.6 69.3 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 124.566 1.146 . . . . 0.0 113.8 -174.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 496' ' ' SER . . . . . . . . . . . . . 32.8 t -164.46 -39.86 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.078 1.351 . . . . 0.0 112.149 -178.624 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 497' ' ' TYR . . . . . . . . . . . . . 52.9 p90 -62.69 172.77 1.5 Allowed 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 125.846 1.658 . . . . 0.0 112.72 169.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 61.5 ttt85 -142.9 149.24 38.21 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.212 1.805 . . . . 0.0 110.218 171.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 499' ' ' ILE . . . . . . . . . . . . . 72.3 mt -133.52 140.8 45.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 C-N-CA 125.726 1.61 . . . . 0.0 109.254 -179.011 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 500' ' ' GLN . . . . . . . . . . . . . 29.8 pt20 -145.31 166.16 26.34 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 126.388 1.875 . . . . 0.0 110.186 173.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' THR . . . . . . . . . . . . . 30.2 p -71.16 163.52 27.46 Favored 'General case' 0 N--CA 1.48 1.044 0 O-C-N 120.454 -1.404 . . . . 0.0 112.226 173.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' TYR . . . . . . . . . . . . . 77.7 t80 -54.43 -41.14 69.04 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 121.534 -0.729 . . . . 0.0 112.117 169.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 503' ' ' ALA . . . . . . . . . . . . . . . -66.23 -39.18 89.36 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 123.873 0.869 . . . . 0.0 113.264 177.229 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 504' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -65.13 -34.09 77.57 Favored 'General case' 0 N--CA 1.473 0.716 0 O-C-N 121.277 -0.889 . . . . 0.0 112.831 174.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 505' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -69.76 -47.48 62.83 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.393 0.677 . . . . 0.0 112.238 171.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 506' ' ' VAL . . . . . . . . . . . . . 6.4 t -53.9 -40.19 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 124.732 1.213 . . . . 0.0 112.632 173.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -64.77 -19.86 65.69 Favored Glycine 0 CA--C 1.54 1.628 0 O-C-N 121.569 -0.707 . . . . 0.0 114.378 177.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -89.92 -19.55 24.42 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 125.205 1.402 . . . . 0.0 113.326 173.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 509' ' ' LYS . . . . . . . . . . . . . 7.1 mtmp? -72.52 2.21 6.75 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.942 1.697 . . . . 0.0 114.295 169.796 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 510' ' ' GLN . . . . . . . . . . . . . 8.1 pt20 -52.17 -18.78 1.63 Allowed 'General case' 0 N--CA 1.475 0.802 0 N-CA-C 116.291 1.96 . . . . 0.0 116.291 -178.702 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 511' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -55.88 -25.61 43.41 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.505 1.122 . . . . 0.0 113.67 170.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 512' ' ' GLY . . . . . . . . . . . . . . . -77.85 -8.28 87.3 Favored Glycine 0 CA--C 1.539 1.593 0 C-N-CA 124.923 1.249 . . . . 0.0 115.293 176.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 513' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -63.41 -18.66 63.95 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.559 1.544 . . . . 0.0 114.553 -178.335 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -72.63 37.02 0.07 Allowed 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 126.491 1.916 . . . . 0.0 114.258 -179.826 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 43.4 t -55.54 -24.54 16.24 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 126.457 1.903 . . . . 0.0 112.806 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 516' ' ' LYS . . . . . . . . . . . . . 22.8 ptmt -57.68 -11.62 2.29 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 127.0 2.12 . . . . 0.0 116.166 172.486 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 517' ' ' SER . . . . . . . . . . . . . 14.7 t -142.49 156.25 45.14 Favored 'General case' 0 N--CA 1.472 0.648 0 C-N-CA 125.164 1.386 . . . . 0.0 112.324 -176.62 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 518' ' ' GLY . . . . . . . . . . . . . . . 164.66 -178.44 39.84 Favored Glycine 0 CA--C 1.541 1.662 0 C-N-CA 125.045 1.307 . . . . 0.0 113.551 -177.365 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 519' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -52.65 -17.23 6.66 Favored 'Trans proline' 0 CA--C 1.544 1.01 0 C-N-CA 125.288 3.992 . . . . 0.0 117.176 -178.18 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 520' ' ' SER . . . . . . . . . . . . . 78.3 p -126.33 7.21 7.06 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 126.068 1.747 . . . . 0.0 113.878 -178.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 521' ' ' SER . . . . . . . . . . . . . 79.3 p -143.51 -0.76 1.06 Allowed 'General case' 0 N--CA 1.478 0.965 0 N-CA-C 115.106 1.521 . . . . 0.0 115.106 -175.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 522' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.22 0 C-N-CA 125.643 1.592 . . . . 0.0 112.947 175.134 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 523' ' ' 7MG . . . . . 0.499 ' H81' " O4'" ' A' ' 524' ' ' GDP . . . . . . . . 0 O4'--C4' 1.422 -2.608 0 C5'-C4'-O4' 111.528 1.663 . 0.0 '__' . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 524' ' ' GDP . . . . . 0.499 " O4'" ' H81' ' A' ' 523' ' ' 7MG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_