data_2rrn_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 2rrn _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 ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 N-CA-C 112.518 -0.233 . . . . 70.23 112.518 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 82.1 m -129.34 110.61 12.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.802 0.334 . . . . 73.14 111.175 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -97.38 112.19 24.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 73.34 111.138 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -101.29 118.59 37.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 71.05 110.93 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.44 112.84 25.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 65.11 111.149 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -132.6 142.91 49.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.256 -0.429 . . . . 74.35 110.922 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.42 146.02 24.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 70.1 110.875 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -151.35 167.35 28.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 71.32 111.091 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -61.04 160.48 21.11 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.623 0.725 . . . . 73.33 110.875 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -23.61 30.6 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.689 2.259 . . . . 71.41 112.317 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 32.9 m-20 -63.56 -35.06 79.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 73.02 110.916 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 46.5 t -73.81 132.94 32.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.475 . . . . 75.23 111.136 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -127.88 177.67 6.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 74.34 110.879 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 91.1 t -51.72 -42.14 30.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 72.31 111.119 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -58.54 -41.21 85.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 73.54 110.892 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 34.8 m -66.31 -44.49 83.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 75.42 111.132 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 7.4 mt -62.03 -51.0 69.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 75.14 110.914 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -64.32 -34.83 79.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 75.0 110.858 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -64.71 -46.38 82.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 73.41 110.89 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -70.27 -35.41 73.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.839 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 36.4 mt -63.61 -52.81 59.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 74.32 110.922 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.78 -37.96 79.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 73.11 110.919 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -59.32 -48.27 82.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.487 . . . . 74.24 110.902 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -66.66 -24.85 66.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 73.44 110.897 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -18.35 18.99 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.74 -0.743 . . . . 75.25 112.505 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -62.21 160.25 32.95 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.657 0.741 . . . . 75.34 110.894 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 90.3 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.653 2.235 . . . . 74.22 112.335 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -107.46 -26.08 5.79 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.702 -0.761 . . . . 71.54 112.478 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -68.05 -51.94 41.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 71.15 110.891 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -75.22 -33.9 61.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 74.2 110.867 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -55.92 170.56 0.29 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 73.12 111.093 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.01 113.35 32.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.232 -0.44 . . . . 73.44 111.101 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 57.9 mt -100.05 126.74 53.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 73.3 111.128 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -125.03 148.7 48.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 74.04 111.181 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -101.25 143.63 31.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 74.44 110.878 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 90.2 t -133.07 103.62 6.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 75.43 111.133 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -68.51 99.22 0.94 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 75.24 110.916 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -76.58 160.19 77.74 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.697 . . . . 74.53 111.07 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 74.5 1.27 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.696 2.264 . . . . 72.21 112.369 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 4.7 t -177.68 138.88 0.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.201 -0.454 . . . . 64.53 111.157 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.73 26.14 4.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.252 -0.431 . . . . 74.33 111.087 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.86 -35.23 3.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 75.53 111.13 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -141.08 177.15 8.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 74.43 110.914 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -147.76 154.01 39.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.072 -0.513 . . . . 75.25 110.847 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -89.02 145.94 25.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.936 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -129.87 124.34 32.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 72.42 110.919 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.64 105.87 16.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 71.34 110.906 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.6 t -96.26 125.66 49.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 70.22 111.161 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 6.0 ttmm -104.63 107.18 18.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 75.22 110.895 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.1 mt -132.3 154.54 81.64 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 74.53 110.897 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 162.08 43.48 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.686 2.257 . . . . 74.24 112.315 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 104.36 1.31 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.669 2.246 . . . . 73.42 112.338 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.0 mt -105.32 -171.07 1.85 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 70.14 110.944 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 9.3 t -72.35 153.12 41.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 73.52 110.883 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -52.08 -44.46 64.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 70.43 110.88 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -60.48 -38.97 85.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.246 -0.434 . . . . 75.24 110.933 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -66.05 -53.22 41.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 73.4 110.856 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 -55.52 -45.54 77.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 71.52 110.868 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mt -69.06 -38.88 79.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 64.23 110.957 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -63.75 -47.03 82.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 54.03 110.908 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 26.1 tp -66.1 -51.14 60.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 75.31 110.945 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -58.23 -49.78 75.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 75.2 110.913 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 8.3 mmt85 -58.39 -53.5 57.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 73.32 110.881 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 10.3 mt -52.7 -43.72 65.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.215 -0.448 . . . . 73.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.3 -56.48 21.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 74.4 110.889 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.46 -13.31 60.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 62.45 111.115 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 22.5 t -79.51 -56.97 3.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.894 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -88.38 -52.18 5.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 74.52 110.902 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.3 tp -67.86 -12.37 60.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.161 -0.472 . . . . 75.21 110.909 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 57.63 23.38 9.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.22 -0.445 . . . . 71.2 110.852 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -65.08 179.84 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 74.41 111.114 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 19.4 m -145.13 110.94 5.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 75.42 111.142 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.4 t -59.01 108.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 74.15 111.135 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 63.8 mt -89.71 -42.23 11.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 72.44 110.898 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -158.55 175.08 14.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 75.13 111.112 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 95.2 p -171.98 145.87 1.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 73.25 110.869 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.1 110.861 -179.932 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.446 -0.262 . . . . 53.43 112.446 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 21.2 m -124.86 107.5 10.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.794 0.33 . . . . 62.2 111.161 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.98 114.09 25.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 74.34 111.083 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -106.1 117.38 33.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 72.43 110.965 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.34 113.6 27.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 73.5 111.143 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -129.14 142.38 50.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 74.42 110.909 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -90.3 130.56 36.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 74.31 110.833 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -133.94 169.42 17.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 74.13 111.127 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -60.49 160.55 17.88 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.652 0.739 . . . . 75.22 110.919 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -20.63 34.31 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.721 2.28 . . . . 72.01 112.302 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -67.97 -43.56 78.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 73.44 110.926 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 61.4 t -64.01 133.01 29.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.147 -0.479 . . . . 73.02 111.149 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -124.58 176.88 6.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 64.24 110.906 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 96.4 t -53.57 -50.02 52.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 75.23 111.108 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -52.05 -37.14 52.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 74.14 110.901 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 93.5 m -69.61 -41.83 75.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 64.21 111.188 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 8.0 mt -63.51 -49.83 72.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 75.41 110.956 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -65.87 -40.13 91.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 73.51 110.906 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -61.08 -45.48 94.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 74.52 110.878 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -69.5 -39.51 77.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 64.22 110.891 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 36.7 mt -58.86 -52.71 64.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 74.21 110.915 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -69.19 -37.96 78.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 75.44 110.873 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -56.18 -47.42 78.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 73.4 110.9 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -70.56 -22.71 62.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 71.54 110.913 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -17.86 19.43 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.739 -0.744 . . . . 73.12 112.519 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -61.3 160.22 25.06 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.614 0.721 . . . . 74.33 110.883 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 93.2 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.671 2.247 . . . . 74.03 112.34 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.1 -38.12 1.28 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.699 -0.762 . . . . 64.14 112.434 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 7.9 pttt -60.53 -30.74 69.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.776 0.322 . . . . 74.52 110.906 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -95.52 -32.79 12.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.92 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -57.28 170.67 0.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 73.33 111.114 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 22.0 t -126.9 111.53 26.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 64.14 111.141 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 72.6 mt -100.53 137.48 27.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 74.4 111.108 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.76 138.48 39.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 74.12 111.118 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -83.96 140.48 31.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 75.12 110.893 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 67.6 t -131.82 100.38 4.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.192 -0.458 . . . . 74.23 111.125 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -67.53 112.1 4.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 72.44 110.915 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -94.51 160.26 31.99 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.619 0.723 . . . . 64.25 111.091 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.78 74.52 1.29 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.672 2.248 . . . . 72.23 112.374 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.0 t -176.43 137.48 0.28 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 71.4 111.096 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.4 25.15 4.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 61.12 111.087 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.99 -35.4 3.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 71.22 111.055 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -143.16 170.89 14.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 71.44 110.874 -179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 60.5 mtt-85 -142.67 160.32 40.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 74.04 110.869 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -91.29 141.99 28.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 75.41 110.887 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -127.86 120.31 27.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 74.11 110.867 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.39 106.22 18.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 74.54 110.935 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 20.0 t -100.93 118.07 47.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 71.0 111.129 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -96.6 107.45 19.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 75.42 110.91 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.3 mt -130.33 154.38 81.47 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.563 0.696 . . . . 74.11 110.93 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 162.15 43.2 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.675 2.25 . . . . 72.34 112.327 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 117.19 4.94 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.695 2.264 . . . . 70.02 112.299 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 2.5 mt -118.83 -170.96 2.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 74.44 110.91 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.1 t -67.23 148.16 52.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 74.2 110.844 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -51.91 -48.02 64.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 73.04 110.85 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -61.95 -44.53 96.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 71.42 110.86 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -61.07 -54.04 49.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.483 . . . . 75.31 110.903 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -54.14 -53.05 58.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.253 -0.431 . . . . 71.45 110.838 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -60.42 -40.0 89.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 75.14 110.902 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -63.25 -48.82 76.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 71.12 110.88 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 49.1 tp -59.01 -51.04 71.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 75.4 110.937 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -56.37 -48.81 76.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 74.34 110.892 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -63.82 -37.93 89.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 72.12 110.833 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 4.8 tt -60.27 -50.95 71.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 74.41 110.921 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -63.35 -50.56 69.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 72.44 110.837 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -61.12 -27.49 68.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 70.04 111.066 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.7 t -80.71 -62.73 1.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.253 -0.431 . . . . 71.34 110.818 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -64.62 -59.44 4.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 64.41 110.88 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.7 tp -68.93 -8.58 45.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.138 -0.483 . . . . 74.1 110.941 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.71 22.56 11.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 75.42 110.901 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.84 179.6 4.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 70.11 111.091 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.5 m -145.05 110.95 5.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 74.41 111.101 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 46.9 t -52.11 112.48 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 74.1 111.131 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 13.4 mt -88.58 -51.95 5.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.149 -0.478 . . . . 73.33 110.932 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.55 173.78 15.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 75.33 111.047 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 95.2 p -160.7 145.41 14.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 71.42 110.84 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.124 -0.489 . . . . 64.21 110.911 -179.967 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 N-CA-C 112.461 -0.255 . . . . 72.25 112.461 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 20.1 m -128.91 109.35 11.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.751 0.31 . . . . 74.41 111.139 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -96.0 123.98 39.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 71.13 111.111 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -115.05 111.29 20.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.213 -0.449 . . . . 75.55 110.921 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.81 113.97 25.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.109 -0.496 . . . . 75.12 111.138 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -130.28 143.09 50.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 60.34 110.924 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -86.99 141.38 28.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 72.0 110.885 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -149.47 160.64 43.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 74.22 111.137 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -51.72 156.85 2.16 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.658 0.742 . . . . 75.33 110.894 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 -9.24 25.63 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.712 2.275 . . . . 74.31 112.375 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -77.87 -44.66 26.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 72.13 110.918 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 97.4 t -56.34 124.29 9.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 74.52 111.153 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -116.67 171.41 7.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 70.24 110.898 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 91.5 t -51.71 -49.52 34.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 72.43 111.101 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -53.02 -40.17 63.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 75.13 110.932 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 89.5 m -66.91 -45.43 77.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 71.54 111.182 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 8.7 mt -61.58 -51.08 70.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.205 -0.452 . . . . 63.23 110.923 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -63.5 -37.0 85.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 71.34 110.863 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 29.5 mtt85 -63.75 -44.29 93.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 75.23 110.895 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -70.25 -36.62 74.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 75.4 110.895 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 38.4 mt -63.04 -53.05 59.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 75.33 110.92 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -67.97 -38.36 82.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 74.41 110.88 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -58.52 -48.56 80.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.3 110.914 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -65.89 -25.07 67.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 73.42 110.896 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.04 -17.88 19.38 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.754 -0.736 . . . . 55.25 112.464 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -62.18 160.21 32.96 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.65 0.738 . . . . 71.43 110.891 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 88.29 0.54 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.691 2.261 . . . . 72.22 112.337 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -104.64 -28.36 5.71 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.783 -0.722 . . . . 73.31 112.513 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt -64.91 -52.02 58.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.744 0.307 . . . . 74.3 110.949 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -75.76 -26.11 57.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 65.13 110.868 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -63.55 167.32 5.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 52.3 111.084 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.92 112.83 30.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 71.52 111.108 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 43.6 mt -97.67 129.35 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 74.22 111.106 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -123.01 142.67 50.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 71.41 111.088 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -98.64 129.43 45.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 72.12 110.915 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 84.7 t -122.88 102.69 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.257 -0.429 . . . . 74.23 111.151 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.17 109.13 10.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.45 . . . . 74.44 110.935 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -88.46 160.31 45.25 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.584 0.707 . . . . 74.3 111.081 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 74.48 1.29 Allowed 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.752 2.301 . . . . 75.13 112.315 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.6 t -176.54 137.02 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 64.31 111.154 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.68 28.64 2.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.435 . . . . 75.2 111.106 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.22 -34.74 3.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 64.02 111.088 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -149.18 169.9 19.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 75.43 110.969 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 44.9 mtp180 -143.63 162.3 36.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 72.44 110.853 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -96.1 141.24 29.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 73.02 110.883 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -128.54 124.31 35.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 73.35 110.878 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.53 110.01 22.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 72.15 110.943 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.5 t -101.71 116.73 45.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.459 . . . . 75.53 111.107 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -96.5 108.25 20.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 71.02 110.881 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.5 mt -132.7 154.45 81.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.611 0.72 . . . . 75.53 110.903 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 162.09 43.43 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.726 2.284 . . . . 74.3 112.327 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 112.93 3.21 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.697 2.264 . . . . 71.21 112.302 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.5 mt -114.89 -172.68 2.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 75.1 110.921 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 31.6 m -64.32 149.34 48.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 62.24 110.88 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.94 -50.83 60.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.144 -0.48 . . . . 72.33 110.871 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -62.54 -37.19 85.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 74.23 110.853 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -64.49 -53.88 41.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.865 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -57.9 -51.11 70.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 74.52 110.82 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.7 -41.07 94.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.224 -0.444 . . . . 72.45 110.943 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -61.91 -47.36 85.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 72.42 110.884 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.24 -51.1 70.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.188 -0.46 . . . . 74.55 110.961 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -55.52 -45.26 77.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 74.23 110.912 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 11.8 mtp85 -68.15 -38.68 82.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 74.44 110.902 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 4.9 tt -60.52 -41.94 95.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 74.35 110.93 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -72.16 -50.64 26.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 73.22 110.832 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.36 67.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 71.03 111.142 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 67.5 p -80.72 -62.67 1.6 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 74.15 110.908 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -65.98 -58.95 4.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.113 -0.494 . . . . 75.35 110.891 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.8 tp -68.92 -8.53 45.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.158 -0.473 . . . . 65.32 110.93 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt 64.61 22.84 12.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 74.1 110.883 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.32 178.46 3.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 65.1 111.077 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 63.3 m -145.03 110.91 5.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 72.21 111.111 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.2 t -52.15 123.63 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 74.15 111.156 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 18.4 mt -103.78 -49.64 3.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 74.43 110.942 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -151.26 172.67 15.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 63.44 111.082 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 89.3 p -163.35 155.23 17.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 63.55 110.886 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 73.51 110.913 -179.959 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.518 -0.233 . . . . 71.03 112.518 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 34.0 m -131.5 110.71 11.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.76 0.314 . . . . 75.02 111.117 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -96.59 119.73 35.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 72.54 111.147 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -110.43 113.77 26.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.995 0.426 . . . . 73.31 110.916 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.3 m -97.89 112.31 24.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.099 -0.501 . . . . 74.24 111.098 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -134.19 142.39 47.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 73.24 110.917 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -88.85 141.5 28.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 75.54 110.892 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -140.4 160.95 38.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 73.53 111.102 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -51.76 156.9 2.16 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.613 0.721 . . . . 74.11 110.89 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -9.14 25.37 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.686 2.257 . . . . 74.22 112.326 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -80.7 -43.08 20.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 73.22 110.82 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.69 134.19 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 75.01 111.116 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -125.81 175.88 7.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 71.43 110.903 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 60.6 t -51.65 -49.91 32.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 74.22 111.113 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -51.93 -41.46 62.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 72.44 110.899 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 88.4 m -67.91 -37.96 82.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.113 -0.494 . . . . 74.14 111.147 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 3.9 mt -64.94 -50.95 64.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 75.03 110.942 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 17.9 ptt85 -63.86 -42.94 97.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 72.12 110.855 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -61.66 -41.73 97.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.447 . . . . 75.2 110.862 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -69.46 -40.39 77.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 71.03 110.906 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.92 -51.77 67.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 72.54 110.936 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.87 -38.34 82.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 75.12 110.895 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -57.92 -48.84 78.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 61.21 110.901 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -67.67 -24.9 65.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.866 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -18.46 18.92 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.704 -0.76 . . . . 71.21 112.48 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -65.35 160.27 59.96 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.705 0.765 . . . . 75.41 110.838 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 95.6 0.56 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.682 2.255 . . . . 74.42 112.334 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -112.3 -51.97 0.53 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.717 -0.754 . . . . 73.13 112.454 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -52.04 -51.56 56.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.713 0.292 . . . . 75.4 110.86 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -27.39 65.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 75.13 110.846 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -68.61 175.26 3.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 74.33 111.083 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.02 111.11 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.466 . . . . 71.32 111.151 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 69.5 mt -97.45 140.92 16.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 75.41 111.119 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.5 m -136.16 147.46 47.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 64.01 111.175 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -98.72 143.62 28.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.221 -0.445 . . . . 74.13 110.933 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 60.0 t -139.0 111.01 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.182 -0.463 . . . . 73.24 111.122 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.66 113.42 15.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 75.3 110.897 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -95.06 160.27 31.25 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.571 0.7 . . . . 73.54 111.099 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 74.56 1.27 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.707 2.271 . . . . 65.0 112.316 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.9 t -176.59 139.24 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 62.44 111.093 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.5 27.27 4.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 72.21 111.098 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.5 -34.94 3.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 54.4 111.12 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -146.03 162.63 37.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.241 -0.436 . . . . 75.24 110.945 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 71.3 mtt-85 -130.37 160.93 32.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.095 -0.502 . . . . 72.02 110.904 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 63.7 tt0 -94.23 139.76 30.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 63.12 110.905 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -127.85 124.64 38.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 74.52 110.905 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.09 103.58 14.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.164 -0.471 . . . . 64.31 110.966 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.5 t -96.82 127.94 48.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 73.23 111.142 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 41.6 tttt -106.91 109.0 20.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 75.55 110.871 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.5 mt -130.6 154.39 81.7 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.587 0.708 . . . . 74.55 110.921 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 162.14 43.2 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.654 2.236 . . . . 74.3 112.31 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 109.63 2.37 Favored 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.697 2.264 . . . . 74.52 112.31 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.7 mt -111.54 -172.35 2.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 75.5 110.943 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.66 153.67 42.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 74.15 110.827 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -52.1 -46.35 65.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 74.25 110.826 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -60.34 -36.0 76.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 74.22 110.877 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -66.36 -56.62 10.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 74.11 110.861 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 -54.93 -44.84 74.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.461 . . . . 74.14 110.878 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.3 mt -67.9 -41.04 83.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 74.05 110.92 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.17 -46.83 85.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.21 -0.45 . . . . 75.53 110.919 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.95 -51.15 63.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 75.33 110.931 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -58.47 -50.25 74.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 75.22 110.902 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -58.45 -53.25 60.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 62.42 110.878 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 5.7 tt -52.76 -43.48 65.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.897 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -60.68 -56.47 20.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.456 . . . . 74.15 110.915 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.32 -13.34 60.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 75.3 111.121 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.65 -57.27 3.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 63.31 110.85 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -88.36 -52.29 5.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 71.42 110.831 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.77 -12.37 60.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 72.21 110.916 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp 57.25 23.53 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 74.45 110.924 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.36 174.21 2.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 73.52 111.079 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 92.4 m -135.49 110.96 9.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.215 -0.448 . . . . 73.5 111.114 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.7 t -58.22 108.34 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 72.51 111.133 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 10.3 mt -84.49 -49.2 8.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 74.54 110.963 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -159.03 173.8 15.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.468 . . . . 73.23 111.144 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 93.8 p -165.57 139.32 4.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 62.42 110.848 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 74.43 110.877 -179.923 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 N-CA-C 112.487 -0.245 . . . . 71.25 112.487 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 2.7 m -125.29 107.51 10.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.743 0.306 . . . . 73.32 111.128 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.0 116.58 28.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 52.51 111.107 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -105.95 114.21 28.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 75.14 110.909 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.54 113.89 26.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 74.32 111.108 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -133.15 147.02 52.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 74.34 110.943 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.92 147.12 23.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 74.31 110.855 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -156.73 165.81 35.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 75.54 111.069 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -53.64 153.52 7.83 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.65 0.738 . . . . 64.33 110.9 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.7 -12.32 32.77 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.692 2.261 . . . . 74.43 112.326 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -74.24 -38.34 63.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 71.24 110.886 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 93.6 t -65.85 124.47 20.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 72.22 111.114 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -114.97 174.65 5.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 74.23 110.894 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 96.2 t -52.05 -45.77 41.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.173 -0.467 . . . . 75.42 111.151 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -54.42 -40.22 68.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 71.23 110.909 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 85.5 m -67.04 -44.17 80.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 73.12 111.179 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 5.1 mt -62.22 -51.04 69.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.435 . . . . 74.53 110.911 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 26.5 ptt180 -64.35 -35.95 82.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 75.34 110.869 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -63.92 -46.05 86.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 74.23 110.894 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -69.99 -36.11 74.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 75.22 110.925 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 35.7 mt -62.66 -52.78 61.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 74.23 110.912 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -68.62 -38.04 80.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 75.33 110.925 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -58.7 -48.02 82.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 72.15 110.878 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -67.38 -24.33 65.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 75.13 110.908 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.01 -18.86 18.6 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.738 -0.744 . . . . 74.35 112.513 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -62.57 160.3 35.77 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.673 0.749 . . . . 72.32 110.896 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 93.18 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.747 2.298 . . . . 72.42 112.348 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -106.96 -41.03 1.74 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.733 -0.746 . . . . 73.52 112.513 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -58.75 -51.67 68.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.755 0.312 . . . . 75.54 110.94 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -31.19 67.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.439 . . . . 72.14 110.932 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -63.64 169.91 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 71.0 111.065 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.96 111.27 25.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 72.24 111.151 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 73.4 mt -96.87 136.35 27.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.2 -0.455 . . . . 74.31 111.131 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.6 m -137.44 140.58 41.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 73.34 111.109 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -91.98 143.0 26.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.443 . . . . 73.53 110.885 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 99.0 t -133.74 125.65 49.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 73.12 111.143 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.97 126.29 30.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 54.24 110.951 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -109.53 160.2 28.69 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.564 0.697 . . . . 71.31 111.112 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 74.6 1.3 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.637 2.224 . . . . 72.45 112.35 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.9 t -179.91 137.11 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 64.54 111.123 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.6 24.49 5.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 74.4 111.114 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.03 -35.31 3.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 71.4 111.106 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -135.38 167.22 21.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 63.25 110.914 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 7.8 mmm-85 -137.26 162.2 34.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 71.41 110.886 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -95.47 144.84 25.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 74.12 110.909 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -131.52 122.29 25.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.45 110.898 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.11 103.57 13.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 75.24 110.899 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.5 t -96.59 128.36 47.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 74.51 111.142 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 38.4 tttm -104.65 108.55 20.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 74.11 110.873 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.9 mt -130.92 154.36 81.95 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.624 0.726 . . . . 70.13 110.924 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 162.09 43.41 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.697 2.265 . . . . 73.33 112.338 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.73 105.21 1.44 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.67 2.247 . . . . 75.52 112.321 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -105.04 -171.1 1.86 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 74.0 110.943 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 43.2 t -73.53 151.04 41.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 75.11 110.847 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -52.0 -50.02 62.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 70.42 110.912 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.3 -49.26 77.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.166 -0.47 . . . . 74.44 110.893 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 14.9 mmp_? -56.45 -56.78 16.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.162 -0.472 . . . . 72.54 110.902 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 26.1 mtp180 -53.35 -46.51 69.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 74.42 110.863 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.1 mt -61.44 -37.67 84.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.446 . . . . 74.14 110.945 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -66.3 -44.28 83.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.172 -0.467 . . . . 74.21 110.897 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.5 tp -63.04 -51.16 67.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 75.34 110.96 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -58.47 -49.55 76.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.457 . . . . 70.13 110.873 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 60.8 mtt-85 -58.48 -53.03 62.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 74.5 110.876 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 5.0 tt -52.71 -44.8 66.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 74.45 110.917 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -59.67 -56.39 22.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 73.23 110.871 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.3 -13.29 60.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 63.54 111.092 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 16.8 t -79.51 -57.26 3.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 75.22 110.849 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -88.37 -52.16 5.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 74.44 110.89 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.3 tp -67.83 -12.47 60.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 75.42 110.927 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 32.9 mmtm 57.62 23.11 8.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 75.54 110.87 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.18 -179.66 0.8 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 53.13 111.09 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 27.8 m -141.71 110.94 6.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 73.11 111.191 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.12 107.61 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 74.35 111.137 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 11.7 mt -83.28 -49.92 8.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 75.32 110.942 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.46 174.92 11.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 72.34 111.057 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 82.7 p -156.98 154.91 30.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 74.54 110.848 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.11 -0.496 . . . . 63.24 110.895 -179.917 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.248 0 N-CA-C 112.455 -0.258 . . . . 73.23 112.455 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 16.0 m -126.77 109.01 11.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.811 0.339 . . . . 75.42 111.153 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.53 130.14 42.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 72.33 111.08 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -119.34 113.6 21.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.203 -0.453 . . . . 75.31 110.953 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.78 110.98 23.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 65.33 111.126 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -132.51 143.51 49.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 72.14 110.957 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -91.05 142.82 27.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.878 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -144.58 170.9 15.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 71.24 111.103 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.28 160.54 40.06 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.607 0.718 . . . . 73.14 110.908 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 -14.53 36.25 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.683 2.255 . . . . 72.32 112.334 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -73.22 -44.99 58.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 73.12 110.849 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 98.5 t -64.06 138.45 23.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 75.43 111.13 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -136.27 178.98 6.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 71.43 110.882 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 48.5 t -51.74 -48.63 37.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 74.45 111.121 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 60.7 tt0 -51.7 -39.91 59.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 65.12 110.852 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.0 m -71.55 -35.42 70.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 72.51 111.195 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 4.9 mt -67.38 -44.71 78.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 73.25 110.888 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -69.97 -46.03 66.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 73.42 110.876 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.8 ptm180 -64.61 -32.7 74.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 54.35 110.895 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -73.8 -45.11 53.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 71.13 110.867 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 50.3 mt -62.58 -42.45 99.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 74.23 110.92 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.17 -37.79 66.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 73.35 110.896 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -61.45 -47.47 85.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 73.5 110.882 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -69.14 -24.29 64.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.164 -0.471 . . . . 75.3 110.913 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.05 -16.75 20.24 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.77 -0.729 . . . . 71.03 112.453 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -68.07 160.25 75.58 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.646 0.736 . . . . 74.41 110.834 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 97.25 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.649 2.233 . . . . 61.44 112.363 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -109.83 -44.9 1.0 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.734 -0.746 . . . . 74.43 112.513 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -60.2 -52.0 67.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.757 0.313 . . . . 74.15 110.946 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -66.71 -33.4 75.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 74.55 110.907 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -63.78 175.4 1.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 71.01 111.096 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -127.04 116.35 44.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 74.34 111.137 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 64.1 mt -96.2 143.0 12.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 74.14 111.114 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.94 135.55 32.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.472 . . . . 74.43 111.167 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -94.89 143.98 26.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 72.31 110.888 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 82.7 t -138.62 106.16 3.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 74.33 111.17 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -72.79 101.38 3.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 73.52 110.907 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -79.96 160.23 69.22 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.589 0.709 . . . . 71.24 111.105 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 74.54 1.26 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.703 2.269 . . . . 74.23 112.377 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.9 t -176.38 139.56 0.35 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 71.22 111.162 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -97.35 26.01 5.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 75.03 111.144 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.63 -35.06 3.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 74.42 111.143 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -144.12 165.22 28.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.474 . . . . 74.03 110.915 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 26.7 mtt-85 -134.57 156.98 47.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.085 -0.507 . . . . 74.42 110.844 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -89.47 135.54 33.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.885 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -123.62 123.54 40.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 62.22 110.892 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.61 107.95 19.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.171 -0.468 . . . . 74.02 110.928 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.57 121.59 51.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.449 . . . . 74.31 111.098 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -99.86 109.27 21.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 73.22 110.933 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.9 mt -131.24 154.26 81.91 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.596 0.712 . . . . 75.53 110.95 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 162.14 43.22 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.731 2.287 . . . . 73.31 112.329 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.86 109.62 2.38 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.622 2.215 . . . . 71.2 112.32 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.5 mt -111.32 -171.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 71.14 110.941 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 7.3 t -71.02 171.09 11.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 72.01 110.86 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -66.91 -48.18 69.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 74.03 110.873 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -59.07 -34.65 72.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 73.55 110.879 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 23.7 mmt180 -66.32 -55.76 14.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.455 . . . . 75.21 110.889 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -56.32 -43.27 78.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 75.14 110.868 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.3 mt -67.66 -39.35 84.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 75.52 110.938 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -66.31 -48.29 70.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 72.53 110.878 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.4 tp -62.02 -51.11 69.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 72.21 110.943 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -58.37 -51.22 70.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 73.15 110.883 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -57.96 -52.64 64.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 75.34 110.874 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 11.0 mt -52.85 -43.64 66.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 75.41 110.87 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -60.63 -56.52 20.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.438 . . . . 74.51 110.89 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.32 -13.29 60.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 70.32 111.09 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.61 -57.51 3.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.436 . . . . 74.34 110.812 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -88.38 -52.22 5.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 74.02 110.883 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.84 -12.42 60.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 74.02 110.883 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.13 23.47 8.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 72.14 110.919 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.51 178.5 1.59 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 73.15 111.07 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 24.4 m -145.08 110.99 5.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 73.04 111.124 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 61.0 t -54.22 124.8 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 75.41 111.113 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 41.2 mt -108.2 -47.32 3.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 75.15 110.921 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -151.94 174.06 14.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 72.43 111.105 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 91.2 p -172.23 148.75 2.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.259 -0.428 . . . . 64.33 110.852 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.485 . . . . 74.14 110.855 -179.932 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.493 -0.243 . . . . 74.24 112.493 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 29.8 m -131.36 112.95 13.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.351 . . . . 73.21 111.135 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.02 127.68 41.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 73.33 111.121 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -116.4 109.84 17.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.451 . . . . 72.34 110.907 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -94.05 114.63 26.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 65.11 111.119 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -137.33 143.56 42.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 74.41 110.927 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -95.86 143.15 27.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 74.22 110.865 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -145.77 171.03 15.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 74.42 111.1 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -61.28 160.66 21.95 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.673 0.749 . . . . 74.53 110.87 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -15.36 37.0 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.66 2.24 . . . . 71.11 112.357 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -69.73 -46.72 65.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 73.43 110.881 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 41.0 t -68.81 127.79 31.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 74.45 111.177 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -123.05 178.77 4.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.449 . . . . 74.15 110.931 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 59.1 t -51.65 -47.77 37.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 74.0 111.133 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -51.77 -40.18 59.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 54.21 110.923 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.1 m -71.12 -35.36 71.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 74.34 111.14 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 3.6 mt -67.3 -45.65 75.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 75.41 110.924 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -68.87 -46.13 69.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 74.43 110.865 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -64.86 -32.28 73.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 74.01 110.822 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -73.42 -44.6 57.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 73.24 110.92 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.74 -41.99 97.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.137 -0.483 . . . . 75.24 110.96 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -73.09 -37.71 66.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 73.13 110.949 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.32 -48.2 80.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.104 -0.498 . . . . 74.22 110.842 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -67.78 -24.44 65.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 73.51 110.858 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -15.93 20.75 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.756 -0.735 . . . . 72.3 112.505 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -64.7 160.27 54.88 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.681 0.753 . . . . 73.32 110.853 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 91.09 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.698 2.266 . . . . 72.34 112.359 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -106.93 -28.16 5.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.717 -0.754 . . . . 73.4 112.518 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -64.38 -51.85 61.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.778 0.323 . . . . 74.11 110.92 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -75.66 -34.38 60.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.5 110.883 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -52.85 165.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 75.03 111.1 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.04 110.95 24.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 74.34 111.112 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 61.1 mt -90.66 142.99 12.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 75.23 111.158 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.59 133.26 47.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 64.31 111.147 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -97.35 118.54 34.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.14 110.936 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 98.1 t -123.32 97.69 4.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.251 -0.431 . . . . 62.31 111.184 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -74.87 99.06 3.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 75.44 110.908 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -66.98 160.32 70.83 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.567 0.699 . . . . 70.22 111.133 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 74.41 1.3 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.707 2.271 . . . . 73.42 112.354 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.9 t 179.1 140.21 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.231 -0.44 . . . . 74.24 111.097 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.41 33.24 1.62 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 71.11 111.111 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.63 -33.94 3.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 75.11 111.122 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -147.74 176.97 9.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 73.1 110.918 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -148.06 149.12 31.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 72.14 110.891 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -91.9 138.84 31.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 72.54 110.938 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -130.64 133.77 46.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 72.44 110.936 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -109.44 106.08 15.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 73.23 110.889 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.02 112.27 27.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 73.43 111.139 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 35.3 tttp -90.47 112.11 23.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 75.24 110.913 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.5 mt -132.67 154.28 81.42 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.592 0.711 . . . . 72.11 110.895 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 162.2 42.99 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.67 2.247 . . . . 74.13 112.342 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 107.46 1.86 Allowed 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.665 2.244 . . . . 73.41 112.361 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -109.12 -170.99 1.76 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.195 -0.457 . . . . 74.03 110.958 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 7.8 p -72.74 152.05 41.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 74.52 110.89 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -51.94 -41.18 61.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.154 -0.475 . . . . 70.13 110.864 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -62.09 -43.93 97.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 65.33 110.858 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? -64.64 -48.48 74.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 74.32 110.903 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -56.41 -52.98 62.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 73.23 110.858 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -64.34 -40.51 96.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 74.34 110.925 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.46 -46.17 91.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 64.41 110.848 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.01 -51.06 65.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 71.24 110.863 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -57.78 -50.12 74.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 72.54 110.871 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -57.94 -53.44 58.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 63.35 110.899 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 tt -52.63 -43.37 65.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 64.45 110.922 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -60.63 -56.53 20.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.21 110.894 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.43 -13.3 60.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 64.3 111.063 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.59 -57.3 3.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 73.03 110.882 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -88.36 -52.24 5.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.14 -0.482 . . . . 73.41 110.914 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.86 -12.42 60.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.54 110.933 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt 57.45 23.27 8.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.168 -0.469 . . . . 75.21 110.901 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.26 -179.05 0.92 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 75.12 111.075 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 89.8 m -145.01 110.95 5.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 73.42 111.171 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 31.7 t -55.62 108.53 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 75.43 111.149 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 27.2 mt -85.43 -43.19 13.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 73.52 110.925 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -166.54 174.54 8.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 74.33 111.059 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 75.7 m -161.38 148.93 15.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.454 . . . . 73.23 110.845 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 74.33 110.874 -179.973 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 112.507 -0.237 . . . . 73.04 112.507 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 61.3 m -125.13 114.15 18.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 71.41 111.129 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -98.87 138.71 35.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 73.04 111.085 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -123.89 112.13 16.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 74.43 110.916 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.8 m -93.89 110.14 21.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 73.14 111.112 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -132.57 145.35 51.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 74.34 110.938 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 23.5 ttp180 -100.0 129.01 46.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 75.42 110.866 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -131.83 170.97 14.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 64.54 111.083 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -58.19 160.26 9.49 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.643 0.735 . . . . 62.33 110.86 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -15.66 37.17 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.724 2.282 . . . . 74.21 112.324 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -71.7 -45.56 61.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 74.11 110.93 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 99.2 t -61.42 121.11 8.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 72.42 111.123 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -117.07 173.79 6.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.913 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.5 t -51.56 -48.5 35.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 52.53 111.111 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -52.44 -39.81 61.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 75.52 110.896 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.3 m -71.2 -35.58 71.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 73.23 111.151 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 2.8 mt -67.36 -45.58 75.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 74.24 110.908 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.6 ptt85 -69.0 -46.05 69.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 72.34 110.892 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -64.86 -32.12 73.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 74.41 110.82 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -73.36 -45.64 53.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.222 -0.445 . . . . 74.41 110.861 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 49.2 mt -62.86 -42.1 99.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 73.14 110.891 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -73.06 -37.65 66.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.431 . . . . 73.21 110.902 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -61.38 -48.92 79.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 73.53 110.955 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -67.51 -22.78 65.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.491 . . . . 71.22 110.907 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -18.43 18.95 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.739 -0.743 . . . . 74.11 112.474 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -66.08 160.3 64.74 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.664 0.745 . . . . 74.12 110.876 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 101.93 0.97 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.71 2.273 . . . . 73.33 112.319 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -120.72 -30.55 1.36 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.731 -0.747 . . . . 75.33 112.472 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.2 -42.28 65.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.707 0.289 . . . . 74.01 110.882 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -80.46 -36.83 32.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 73.41 110.898 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -59.21 177.46 0.17 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.159 -0.473 . . . . 72.24 111.068 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.0 112.52 29.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 73.52 111.123 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 47.3 mt -96.16 128.06 47.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 71.41 111.12 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.98 147.21 46.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 74.02 111.122 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.5 tm0? -103.61 144.02 31.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 74.31 110.927 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 94.5 t -136.57 108.73 7.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 72.14 111.127 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.01 109.72 15.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 74.32 110.951 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -89.44 160.32 42.39 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.561 0.696 . . . . 71.1 111.139 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 74.44 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.696 2.264 . . . . 75.33 112.35 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t 179.27 136.54 0.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 75.2 111.127 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -96.46 32.32 2.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 65.33 111.07 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.97 -34.16 3.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 73.35 111.092 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -150.81 145.67 25.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.208 -0.451 . . . . 74.34 110.944 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -115.98 154.39 29.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.117 -0.492 . . . . 74.43 110.87 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -92.18 149.23 21.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 72.13 110.893 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -138.96 133.51 31.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 74.43 110.907 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.15 106.8 16.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.131 -0.486 . . . . 71.21 110.937 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 19.9 t -95.97 113.27 29.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 75.35 111.159 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 2.9 tptm -92.46 108.57 20.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.24 110.901 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.8 mt -132.45 154.55 81.6 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.608 0.718 . . . . 74.45 110.907 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 162.29 42.62 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.719 2.28 . . . . 63.52 112.382 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 103.98 1.25 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.7 2.267 . . . . 72.05 112.334 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.4 mt -103.62 -171.05 1.87 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 75.2 110.917 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 28.4 t -70.22 149.06 47.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 73.02 110.815 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -51.71 -48.45 63.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 75.42 110.848 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.1 -44.82 96.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 72.43 110.927 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 21.7 mmt85 -59.07 -55.85 29.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 73.31 110.843 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 67.4 mtp180 -53.83 -53.0 58.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.881 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.1 mt -56.41 -37.01 69.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 75.03 110.903 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.0 -46.0 83.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 73.31 110.864 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 22.1 tp -61.44 -50.86 71.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 74.13 110.906 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -57.3 -50.91 71.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 75.03 110.902 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -58.04 -52.71 64.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.486 . . . . 74.33 110.85 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.4 tt -52.6 -44.19 65.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 73.11 110.913 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -60.43 -56.29 23.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 73.21 110.928 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.01 -13.43 59.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 71.44 111.142 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.9 t -79.66 -57.72 3.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 64.44 110.887 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -88.29 -52.18 5.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.118 -0.492 . . . . 73.3 110.91 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.82 -12.43 60.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 74.41 110.944 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 26.8 mmtp 56.74 24.0 8.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 74.41 110.867 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.77 177.72 1.98 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 73.43 111.076 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 40.8 m -140.28 110.87 6.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 71.04 111.136 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.51 102.03 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 74.51 111.137 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 28.6 mt -77.85 -43.25 30.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 75.4 110.917 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -168.55 176.44 5.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 65.23 111.109 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 99.2 p -160.18 153.94 22.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 60.54 110.864 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 8.2 pm0 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 75.12 110.895 -179.972 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.465 -0.254 . . . . 54.53 112.465 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 25.7 m -128.52 113.4 15.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.825 0.345 . . . . 74.0 111.116 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.91 142.64 27.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 64.31 111.123 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -132.11 110.67 10.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.244 -0.435 . . . . 74.42 110.921 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.73 114.78 26.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 72.41 111.123 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -135.76 142.56 44.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 71.45 110.962 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -88.3 146.94 25.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 74.13 110.865 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -152.54 169.73 21.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 74.3 111.131 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -70.49 160.66 80.61 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.669 0.747 . . . . 71.12 110.861 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -10.95 29.76 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.669 2.246 . . . . 74.32 112.301 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -71.29 -31.15 67.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 75.31 110.872 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 23.7 t -86.83 134.77 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.139 -0.482 . . . . 75.31 111.134 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -127.06 177.56 6.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.445 . . . . 74.44 110.9 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 81.8 t -51.96 -50.01 35.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 70.02 111.131 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -53.72 -40.07 65.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 73.55 110.923 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 63.7 m -67.52 -42.8 82.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 72.43 111.162 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 6.6 mt -61.21 -51.06 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 72.51 110.933 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -64.1 -40.12 95.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.85 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -60.46 -44.12 96.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.835 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -70.81 -39.55 73.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.441 . . . . 72.31 110.877 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 36.0 mt -58.87 -49.9 76.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 73.34 110.917 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -72.13 -37.98 69.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 74.31 110.886 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -56.06 -48.75 75.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 63.32 110.914 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 13.7 mmmt -69.71 -23.7 63.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.473 . . . . 73.21 110.948 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.0 -17.68 19.64 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.758 -0.734 . . . . 63.52 112.495 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -63.4 160.26 43.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.628 0.728 . . . . 71.11 110.881 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 93.39 0.52 Allowed 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.673 2.249 . . . . 71.13 112.348 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.16 -28.23 3.41 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.705 -0.76 . . . . 61.44 112.468 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -70.43 -51.74 27.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.718 0.294 . . . . 74.53 110.888 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.38 -34.34 67.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 75.03 110.932 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -61.46 172.32 1.2 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 75.22 111.107 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.97 116.47 44.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 64.31 111.101 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 65.5 mt -98.36 123.2 50.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 74.35 111.158 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.7 m -113.91 143.15 45.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 65.52 111.12 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -98.16 128.91 44.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 74.53 110.923 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.72 92.27 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 72.42 111.16 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.7 114.85 5.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 74.05 110.929 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -88.64 161.17 42.79 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.56 0.695 . . . . 75.33 111.128 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 72.17 1.47 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.762 2.308 . . . . 73.31 112.325 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.4 t 177.23 141.9 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 74.12 111.15 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.87 31.35 2.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 52.32 111.138 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -126.06 -35.67 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 74.55 111.06 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -150.1 150.55 31.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.226 -0.443 . . . . 74.54 110.898 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.18 161.76 34.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 73.13 110.859 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 -94.71 152.38 18.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 64.51 110.869 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -136.31 126.94 27.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 72.23 110.868 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.61 107.46 19.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 72.43 110.896 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.4 t -95.88 112.02 27.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 75.41 111.114 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -91.55 108.44 19.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.16 -0.473 . . . . 73.11 110.903 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.3 mt -131.86 154.47 81.77 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.605 0.717 . . . . 74.34 110.893 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 162.22 42.94 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.675 2.25 . . . . 63.44 112.352 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 106.45 1.67 Allowed 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.733 2.289 . . . . 70.42 112.317 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -108.83 -171.02 1.77 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 74.34 110.941 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 53.7 m -71.79 153.83 41.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 74.55 110.848 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -52.27 -47.44 65.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.128 -0.487 . . . . 63.41 110.844 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -58.95 -37.77 77.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 74.41 110.926 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.4 mmp_? -64.22 -58.04 7.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 73.35 110.839 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -53.1 -47.02 68.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 73.21 110.873 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mt -66.01 -37.04 84.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 73.04 110.882 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -65.97 -46.66 77.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.831 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -63.99 -51.18 65.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 73.23 110.921 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -58.14 -50.45 73.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 72.12 110.854 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -58.05 -53.41 58.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 72.02 110.878 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.9 mt -52.63 -43.59 65.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 71.32 110.941 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.53 -56.56 19.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 75.41 110.857 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.26 -13.32 60.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 75.13 111.1 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 22.8 t -79.6 -57.39 3.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 75.22 110.845 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -88.4 -52.18 5.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 74.22 110.879 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -12.36 60.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 71.55 110.91 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.5 mmmt 57.11 23.58 8.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 71.35 110.894 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.95 177.86 1.57 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.44 111.077 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 49.1 m -140.39 111.01 6.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 75.13 111.12 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 61.8 t -60.47 119.56 4.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 73.34 111.108 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 17.6 mt -103.09 -48.03 4.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 55.12 110.89 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -143.61 170.09 16.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 74.02 111.073 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 54.8 p -175.8 133.99 0.28 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 64.14 110.851 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 73.05 110.877 -179.974 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 N-CA-C 112.477 -0.249 . . . . 71.2 112.477 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 97.0 m -129.95 106.89 8.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.783 0.325 . . . . 74.21 111.126 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.97 136.42 35.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 72.21 111.121 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -124.2 111.18 15.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.252 -0.431 . . . . 74.04 110.906 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -94.92 110.97 22.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 73.2 111.172 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -135.73 146.38 47.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.246 -0.434 . . . . 64.04 110.937 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 26.1 mtp180 -97.4 127.22 43.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.16 -0.473 . . . . 74.13 110.868 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -123.84 171.06 9.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 72.44 111.134 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -66.29 160.63 63.88 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.667 0.746 . . . . 72.25 110.901 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -16.3 37.63 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.692 2.261 . . . . 73.22 112.366 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -72.5 -34.02 67.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 65.33 110.887 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 85.4 t -80.14 124.59 38.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.475 . . . . 74.35 111.132 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -118.61 178.85 4.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 74.54 110.878 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 38.7 t -51.62 -48.73 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 75.24 111.158 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -51.71 -41.12 61.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 70.31 110.882 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.4 m -71.09 -34.55 71.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 62.41 111.14 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 2.3 mt -67.48 -44.54 78.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.451 . . . . 74.34 110.872 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -70.08 -45.55 66.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 74.11 110.849 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -65.05 -32.62 74.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 72.54 110.84 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -73.58 -46.3 48.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 74.02 110.884 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.7 -42.3 98.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 74.45 110.893 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.24 -37.55 66.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 74.13 110.907 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -60.58 -49.31 78.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 75.13 110.897 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -24.02 67.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 74.2 110.918 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.07 -17.73 19.43 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.794 -0.717 . . . . 75.32 112.518 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -68.01 160.3 75.05 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.666 0.746 . . . . 71.03 110.852 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 100.25 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.693 2.262 . . . . 75.03 112.29 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -119.85 -25.19 2.62 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.757 -0.735 . . . . 61.54 112.458 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -72.88 -40.18 65.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.735 0.302 . . . . 71.22 110.914 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -85.23 -34.29 22.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 75.2 110.873 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -61.43 -177.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.445 . . . . 65.54 111.087 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 23.4 t -126.98 143.06 41.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 72.34 111.108 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 30.6 mt -125.61 120.4 57.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.174 -0.466 . . . . 60.15 111.129 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.53 141.6 48.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 74.3 111.163 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -100.37 141.65 32.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 73.14 110.91 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 93.2 t -135.0 108.55 10.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 71.53 111.164 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 12.4 tm0? -71.19 116.74 11.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.947 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -96.22 160.23 30.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.575 0.702 . . . . 61.14 111.129 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 74.6 1.28 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.663 2.242 . . . . 71.33 112.306 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.3 t 179.99 138.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 75.04 111.1 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.48 27.18 3.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 73.3 111.09 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.53 -34.93 3.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 75.12 111.081 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -144.98 164.75 30.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 73.42 110.943 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 48.9 mtm180 -137.33 160.61 38.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 72.42 110.898 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -93.98 149.31 21.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 72.02 110.886 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -142.43 134.57 27.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 72.23 110.848 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.36 107.72 18.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.095 -0.502 . . . . 73.31 110.91 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.3 t -96.2 112.46 28.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 74.31 111.1 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 34.7 tttt -91.93 108.93 20.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.479 . . . . 73.33 110.901 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.3 mt -131.89 154.42 81.74 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.631 0.729 . . . . 64.41 110.89 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 162.25 42.79 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.627 2.218 . . . . 74.32 112.341 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 112.42 3.08 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.678 2.252 . . . . 64.33 112.308 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.79 -170.98 1.77 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 73.32 110.91 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 40.9 t -68.88 155.51 40.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 55.34 110.844 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -54.73 -50.31 68.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 75.33 110.905 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -60.06 -37.16 79.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.458 . . . . 75.33 110.881 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -64.19 -55.6 20.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 75.4 110.893 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 53.7 mtm180 -55.81 -53.06 61.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 73.54 110.844 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.0 mt -59.23 -37.77 78.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 71.12 110.897 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.93 -50.07 67.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 75.14 110.877 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 23.0 tp -57.92 -51.08 71.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 61.42 110.922 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -57.26 -50.89 71.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.454 . . . . 74.21 110.869 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -57.88 -51.91 67.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 75.41 110.878 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.8 -44.65 66.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 74.03 110.851 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -60.39 -56.35 22.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 74.03 110.878 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.87 -13.47 59.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 73.34 111.102 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.61 -57.96 3.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 75.21 110.859 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -88.26 -52.2 5.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.489 . . . . 75.35 110.907 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.76 -12.47 60.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 73.54 110.871 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt 56.3 24.37 8.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 75.35 110.905 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.41 174.14 3.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 73.22 111.091 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 93.3 m -133.72 111.69 10.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 75.45 111.13 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.98 109.04 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 50.41 111.15 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 11.7 mt -86.84 -45.38 10.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 75.41 110.922 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.61 172.38 14.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 70.13 111.144 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 20.6 p -158.26 157.37 32.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 73.24 110.877 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 75.43 110.892 -179.951 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.51 -0.236 . . . . 63.3 112.51 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 25.0 m -127.25 108.65 11.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.835 0.35 . . . . 73.22 111.147 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.41 129.99 42.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 74.45 111.151 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -118.24 113.32 21.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.244 -0.434 . . . . 74.42 110.936 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -94.38 110.33 22.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 72.54 111.115 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -130.51 143.6 50.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 75.55 110.933 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -94.1 126.77 39.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 74.51 110.894 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -127.02 170.95 11.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 74.42 111.141 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -61.21 160.42 22.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.666 0.746 . . . . 75.14 110.881 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -17.76 37.36 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.698 2.265 . . . . 75.14 112.303 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -73.02 -44.15 61.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 73.0 110.944 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 95.7 t -60.71 125.55 17.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 73.14 111.143 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -123.48 176.68 6.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 71.42 110.862 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 90.3 t -51.63 -49.24 35.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.487 . . . . 73.5 111.096 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -51.17 -40.27 58.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 73.52 110.911 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.3 m -72.96 -35.12 66.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 73.24 111.154 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 4.8 mt -67.46 -44.1 79.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 74.55 110.908 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.05 -46.13 62.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 73.21 110.888 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -63.97 -33.21 75.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 74.43 110.907 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -73.98 -47.44 37.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.465 . . . . 73.5 110.835 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 35.8 mt -59.6 -43.35 93.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 74.35 110.91 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -73.09 -37.76 66.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.169 -0.469 . . . . 73.02 110.92 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.35 -49.04 78.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 74.01 110.871 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -24.76 64.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 74.34 110.901 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -17.98 19.34 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.754 -0.736 . . . . 73.04 112.475 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -61.54 160.28 26.81 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.66 0.743 . . . . 71.44 110.846 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 86.87 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.672 2.248 . . . . 74.43 112.32 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -108.89 -22.09 7.12 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.745 -0.74 . . . . 74.23 112.494 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -75.85 -40.79 54.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.727 0.299 . . . . 75.4 110.839 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -85.28 -29.45 24.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.427 . . . . 74.2 110.887 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -62.77 173.8 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.466 . . . . 64.42 111.078 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.05 117.04 46.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.42 111.152 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 62.1 mt -96.91 137.33 24.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 75.3 111.071 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.13 150.35 52.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 73.45 111.146 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -102.5 144.0 31.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.913 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.5 t -138.62 108.95 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 72.43 111.136 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -77.56 107.42 10.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 73.14 110.929 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -88.9 160.22 44.13 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.578 0.704 . . . . 74.13 111.103 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 74.54 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.68 2.254 . . . . 72.33 112.353 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t -176.03 140.05 0.4 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 75.14 111.136 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -99.95 26.31 6.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 65.3 111.096 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.69 -34.02 3.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 73.52 111.1 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -145.1 157.28 44.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 74.41 110.925 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.16 157.43 34.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 74.31 110.873 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -93.73 141.86 28.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 74.23 110.901 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -130.46 128.95 42.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 72.12 110.846 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -104.15 105.51 15.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 75.25 110.957 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.2 t -95.98 116.68 38.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 73.54 111.148 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 5.7 tptm -94.74 107.41 19.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 73.53 110.896 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.4 mt -130.65 154.29 81.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.56 0.695 . . . . 70.31 110.939 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 162.14 43.25 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.646 2.231 . . . . 61.21 112.341 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 108.83 2.17 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.682 2.254 . . . . 74.33 112.338 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.2 mt -109.41 -171.08 1.77 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 71.3 110.93 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.84 154.88 40.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 72.14 110.82 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -51.98 -46.08 64.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.096 -0.502 . . . . 71.21 110.875 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.85 -36.12 78.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 71.34 110.877 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -65.04 -54.35 31.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 72.24 110.888 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 43.0 mtt180 -57.16 -48.11 79.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 72.32 110.865 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.7 mt -63.8 -43.59 95.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 75.14 110.888 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -62.92 -44.51 95.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 73.34 110.892 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.2 tp -62.35 -51.23 68.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.157 -0.474 . . . . 53.05 110.938 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -56.08 -49.66 73.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 75.04 110.919 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -57.93 -51.91 67.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 72.43 110.857 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.88 -44.35 66.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 63.12 110.9 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -60.31 -56.74 17.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 72.03 110.84 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.18 -13.11 59.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 70.34 111.122 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.73 -58.31 3.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 60.44 110.816 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -88.56 -52.17 5.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 75.14 110.828 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.8 tp -67.76 -12.71 61.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 75.23 110.919 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp 56.65 23.36 7.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.22 110.904 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -71.2 -179.82 2.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 74.02 111.125 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 94.2 m -144.99 111.29 5.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 73.54 111.144 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.4 t -53.23 122.81 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 75.31 111.158 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 18.2 mt -101.28 -47.55 4.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 73.31 110.893 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -158.28 175.15 14.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 64.52 111.092 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 88.5 p -161.33 152.71 18.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.443 . . . . 75.24 110.867 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 74.44 110.845 -179.948 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 N-CA-C 112.481 -0.247 . . . . 74.1 112.481 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 95.6 m -130.04 112.59 13.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.792 0.33 . . . . 62.44 111.135 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.95 143.89 26.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 64.43 111.085 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -131.44 116.41 17.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 74.0 110.916 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.1 112.48 24.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.124 -0.489 . . . . 55.31 111.13 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -134.78 147.8 50.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.967 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 6.8 ttt180 -93.17 136.23 33.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.455 . . . . 75.43 110.883 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -139.67 161.86 36.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 71.34 111.105 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.2 pm0 -51.98 156.87 2.35 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.685 0.755 . . . . 73.44 110.879 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -8.82 24.57 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.65 2.234 . . . . 73.22 112.339 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -82.43 -42.4 18.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 75.35 110.881 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 97.7 t -64.16 124.09 18.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 75.12 111.14 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -120.55 177.42 5.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.203 -0.453 . . . . 75.4 110.865 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 47.7 t -51.46 -47.49 35.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 74.1 111.113 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -51.83 -41.65 61.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.23 110.852 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.9 m -70.79 -34.46 71.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 72.42 111.123 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 2.6 mt -67.2 -45.42 76.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 73.24 110.9 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 -69.89 -45.42 67.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 72.25 110.83 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -64.93 -31.94 73.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 72.05 110.9 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -75.17 -43.24 53.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 73.52 110.868 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 51.0 mt -63.48 -43.96 95.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.465 . . . . 75.53 110.885 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -71.71 -42.07 67.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 71.21 110.9 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.89 -49.0 78.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 71.24 110.868 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -66.24 -23.98 66.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.462 . . . . 74.01 110.896 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -18.67 18.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.706 -0.759 . . . . 74.54 112.472 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -67.52 160.25 73.42 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.682 0.753 . . . . 73.25 110.851 -179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 101.7 0.94 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.671 2.247 . . . . 74.2 112.335 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -123.51 -33.06 0.84 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.719 -0.753 . . . . 41.41 112.496 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 20.5 pttt -61.52 -43.5 98.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.746 0.308 . . . . 73.55 110.911 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -83.38 -31.51 26.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 74.23 110.883 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -55.79 172.06 0.19 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 75.51 111.114 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.6 t -126.93 111.09 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 72.14 111.109 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 34.5 mt -92.28 142.45 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 75.42 111.147 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.53 134.83 36.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 74.35 111.157 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -91.52 142.76 27.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 71.52 110.883 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 61.7 t -138.15 108.27 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 70.04 111.168 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -74.9 132.68 41.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 75.35 110.919 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -116.1 160.3 36.11 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.593 0.711 . . . . 45.12 111.099 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 74.45 1.3 Allowed 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.65 2.234 . . . . 64.21 112.358 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 3.0 t -179.83 141.77 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.254 -0.43 . . . . 64.14 111.16 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -101.04 29.02 4.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 74.3 111.142 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.6 -34.66 3.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 71.23 111.084 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -146.38 166.09 27.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.442 . . . . 73.14 110.929 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 19.8 mtm-85 -136.83 160.92 37.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 72.41 110.873 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -93.94 140.21 29.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 75.11 110.903 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -130.8 132.42 45.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.115 -0.493 . . . . 73.44 110.907 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.99 107.05 15.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 73.23 110.904 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.1 t -97.35 133.5 38.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 74.51 111.098 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 43.6 tttt -108.65 107.94 18.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 73.24 110.93 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.8 mt -129.7 154.61 80.98 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.628 0.728 . . . . 75.34 110.89 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.28 42.67 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.716 2.278 . . . . 72.3 112.306 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 110.95 2.67 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.679 2.252 . . . . 71.34 112.361 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.6 mt -114.28 -170.99 1.83 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.429 . . . . 74.43 110.915 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.1 p -74.55 154.03 38.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 73.45 110.862 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -51.92 -40.62 61.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 74.34 110.839 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -61.25 -42.88 99.38 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.455 . . . . 73.43 110.926 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -63.34 -52.58 61.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 75.23 110.903 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -54.5 -52.95 60.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 71.41 110.845 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.36 -36.18 82.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 70.41 110.913 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -64.54 -49.84 69.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 72.01 110.903 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -62.53 -51.0 69.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 75.44 110.975 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -56.37 -47.71 78.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 72.53 110.891 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -59.87 -53.89 52.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.848 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -52.66 -44.08 65.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 72.23 110.898 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.26 -56.46 21.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 75.54 110.887 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.14 -13.37 60.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 75.4 111.16 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 20.0 t -79.57 -57.54 3.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 71.42 110.829 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -88.38 -52.26 5.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 75.14 110.899 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.76 -12.46 60.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.111 -0.495 . . . . 73.22 110.952 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 23.1 mmtp 57.16 23.46 8.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 65.52 110.893 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.32 178.39 1.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.454 . . . . 74.33 111.094 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 90.8 m -145.01 110.91 5.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 75.21 111.154 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 36.4 t -54.73 131.88 17.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 74.25 111.117 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 46.5 mt -115.18 -43.6 3.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 74.52 110.888 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -157.44 174.85 14.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 64.24 111.087 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 5.2 p -169.27 148.63 3.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 74.43 110.813 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.113 -0.494 . . . . 75.45 110.927 179.988 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.544 -0.222 . . . . 64.41 112.544 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 33.2 m -125.19 108.35 11.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.788 0.328 . . . . 73.31 111.116 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -96.75 125.22 41.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 74.21 111.073 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -114.82 112.36 22.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 73.11 110.929 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.41 112.92 24.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 72.45 111.166 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -134.01 143.2 47.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.246 -0.434 . . . . 64.25 110.924 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -89.27 142.58 27.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 75.23 110.842 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -141.66 166.65 24.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.156 -0.475 . . . . 72.33 111.148 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -55.88 160.55 4.27 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.674 0.749 . . . . 73.35 110.876 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -17.67 37.19 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.632 2.222 . . . . 72.14 112.358 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -76.13 -40.45 52.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 71.34 110.955 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 82.7 t -59.22 137.33 21.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 72.53 111.091 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -133.65 175.65 9.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 70.22 110.904 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 85.1 t -51.92 -47.76 40.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.463 . . . . 64.32 111.146 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -54.12 -39.67 66.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 65.54 110.901 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 85.5 m -67.01 -43.13 83.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 74.31 111.143 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 6.4 mt -62.63 -51.08 68.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.45 . . . . 75.41 110.927 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -64.42 -36.28 83.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 74.12 110.897 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -63.95 -45.71 87.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 71.34 110.869 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -70.08 -36.13 74.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 74.42 110.856 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 43.4 mt -62.89 -52.93 61.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.166 -0.47 . . . . 75.21 110.947 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -68.71 -38.01 79.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.471 . . . . 75.32 110.852 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.88 -47.51 84.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.55 110.934 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -67.82 -25.08 65.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 74.54 110.908 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 113.96 -18.28 19.23 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.754 -0.736 . . . . 71.01 112.505 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -62.96 160.28 39.4 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.655 0.74 . . . . 72.44 110.867 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 91.31 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 65.42 112.303 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -108.76 -30.17 3.84 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.733 -0.746 . . . . 70.42 112.518 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -62.73 -51.96 65.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.768 0.318 . . . . 71.1 110.908 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -75.37 -29.89 60.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 72.24 110.918 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -57.43 168.66 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 75.35 111.119 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.01 111.13 24.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 73.12 111.109 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 53.8 mt -99.47 134.66 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.474 . . . . 74.14 111.14 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 4.0 m -134.68 155.24 50.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.182 -0.463 . . . . 75.02 111.105 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -102.85 143.99 31.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 74.03 110.922 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.0 t -136.96 127.01 39.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 75.14 111.115 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -80.98 99.13 8.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 74.14 110.899 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -79.62 160.26 70.05 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.573 0.701 . . . . 62.32 111.081 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 74.47 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.681 2.254 . . . . 73.41 112.365 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t -177.32 139.23 0.25 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 73.42 111.151 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.0 24.98 6.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 61.22 111.105 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.19 -35.49 2.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 72.42 111.082 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -136.83 161.41 36.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 72.51 110.891 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -123.75 155.56 37.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 75.21 110.895 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -90.55 144.46 25.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 72.2 110.887 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -130.2 124.55 32.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 74.4 110.866 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.14 105.09 16.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.114 -0.494 . . . . 73.51 110.926 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.6 t -96.02 123.81 48.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 72.32 111.096 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -102.68 108.56 19.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 75.23 110.904 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.4 mt -132.06 154.45 81.69 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.622 0.725 . . . . 74.52 110.89 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 162.14 43.2 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.682 2.254 . . . . 64.43 112.333 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 107.28 1.83 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.676 2.251 . . . . 73.25 112.362 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 5.1 mt -109.85 -171.03 1.76 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.235 -0.439 . . . . 72.1 110.928 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.01 153.69 41.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 74.24 110.871 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -52.09 -45.86 65.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.146 -0.479 . . . . 74.03 110.867 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -60.05 -37.46 79.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.176 -0.466 . . . . 73.31 110.903 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -65.65 -57.47 8.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 72.32 110.849 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -53.25 -46.43 69.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 74.32 110.892 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -67.02 -38.8 86.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 74.23 110.96 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -64.08 -46.4 84.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 75.35 110.887 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.12 -51.06 63.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.48 . . . . 75.54 110.911 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -58.34 -49.05 78.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 73.2 110.896 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -58.76 -53.73 55.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 75.04 110.872 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.1 mt -52.75 -43.66 65.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 61.52 110.894 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.31 -56.39 22.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 70.45 110.898 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.58 -13.23 60.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 61.41 111.091 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.6 t -79.55 -56.84 4.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 64.02 110.873 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -88.37 -52.16 5.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 73.41 110.91 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -12.17 60.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 75.3 110.905 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt 57.57 23.46 9.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 73.34 110.877 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -64.58 -179.55 0.5 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 70.43 111.1 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 90.5 m -144.71 110.88 5.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 72.51 111.188 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.8 t -57.04 118.87 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 74.01 111.172 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 55.8 mt -99.75 -47.7 4.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 73.42 110.874 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.53 173.45 16.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 71.51 111.106 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 6.1 p -165.49 149.95 8.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 74.25 110.85 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.1 -0.5 . . . . 73.1 110.904 -179.995 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 N-CA-C 112.482 -0.247 . . . . 72.14 112.482 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 7.1 m -122.84 107.54 11.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.776 0.322 . . . . 71.12 111.141 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.3 130.09 42.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 72.01 111.128 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -120.32 110.53 16.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 75.01 110.902 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.8 m -94.26 111.35 23.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 74.34 111.18 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -130.31 143.16 50.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 70.33 110.962 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 -89.67 148.02 23.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 75.33 110.828 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -153.35 169.64 22.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 74.24 111.102 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -62.6 160.54 34.06 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.646 0.736 . . . . 63.34 110.9 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -17.6 37.37 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.67 2.247 . . . . 65.34 112.358 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 38.8 m-20 -69.18 -45.73 69.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 72.43 110.913 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 42.7 t -65.22 129.56 29.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 75.35 111.127 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -124.16 177.29 5.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.21 110.886 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.8 t -51.7 -48.07 37.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 71.31 111.137 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -52.02 -41.05 61.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.899 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 95.4 m -68.95 -39.55 79.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.35 111.145 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 10.2 mt -64.03 -51.08 65.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 71.33 110.916 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -65.09 -40.95 95.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 75.43 110.85 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -61.34 -43.27 99.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 64.42 110.828 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -70.51 -37.75 74.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 73.32 110.932 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 33.9 mt -61.33 -51.82 67.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 74.12 110.89 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -69.62 -37.98 77.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 75.42 110.879 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -57.39 -48.96 77.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.485 . . . . 73.12 110.897 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -67.36 -24.05 65.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.191 -0.459 . . . . 73.13 110.89 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.1 -18.3 18.85 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.725 -0.75 . . . . 75.54 112.473 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -64.54 160.21 53.98 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.682 0.753 . . . . 73.44 110.844 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 96.06 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.689 2.259 . . . . 63.03 112.357 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.76 -41.23 0.94 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.746 -0.74 . . . . 75.22 112.506 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -40.28 84.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.71 0.291 . . . . 74.44 110.877 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -83.75 -26.37 29.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 74.21 110.896 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -66.28 173.17 3.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 62.55 111.108 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.02 113.01 30.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 74.42 111.129 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 46.6 mt -102.29 132.96 47.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 74.33 111.096 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -127.76 141.77 51.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.14 -0.482 . . . . 72.35 111.154 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -92.92 126.15 37.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.266 -0.424 . . . . 74.14 110.921 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 92.8 t -116.35 99.22 7.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 74.24 111.118 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.24 113.71 10.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 75.3 110.892 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -94.3 160.31 32.17 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.588 0.709 . . . . 63.43 111.091 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 74.53 1.31 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.687 2.258 . . . . 73.31 112.305 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.5 t -177.0 137.17 0.23 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 74.13 111.171 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.77 28.1 3.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 74.4 111.116 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.43 -34.66 3.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 73.42 111.06 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -147.97 166.37 27.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.417 . . . . 63.21 110.872 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -140.35 159.67 41.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 71.53 110.868 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -93.24 141.47 28.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 75.04 110.881 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -127.31 124.34 38.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 74.1 110.869 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.23 111.58 23.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.121 -0.491 . . . . 75.21 110.936 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.5 t -104.17 117.0 49.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 73.23 111.094 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 5.3 ttmm -97.87 109.3 22.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.899 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.5 mt -131.71 154.38 81.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.657 0.741 . . . . 72.25 110.893 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 162.17 43.11 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.661 2.241 . . . . 72.43 112.352 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 105.28 1.47 Allowed 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.648 2.232 . . . . 73.3 112.361 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.7 mt -107.32 -171.06 1.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 74.1 110.937 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 46.4 t -71.18 151.24 44.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 52.51 110.862 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.93 -47.54 64.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 75.54 110.877 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -58.38 -41.05 83.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.162 -0.472 . . . . 73.12 110.913 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -64.44 -53.32 50.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 72.3 110.894 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 8.9 mtt85 -53.28 -52.99 57.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 73.31 110.908 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.2 mt -63.85 -34.42 77.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.183 -0.462 . . . . 73.43 110.894 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -65.86 -46.79 77.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 73.03 110.9 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 26.3 tp -64.86 -51.09 63.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.133 -0.485 . . . . 75.31 110.913 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -56.68 -49.39 75.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.455 . . . . 55.43 110.885 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -58.0 -53.41 58.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.462 . . . . 74.5 110.898 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 9.3 mt -52.79 -43.27 65.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 75.42 110.912 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.55 -56.51 20.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 75.03 110.88 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.58 -13.23 60.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.119 -0.492 . . . . 73.43 111.073 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 23.2 t -79.55 -56.96 3.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 74.05 110.87 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -88.33 -52.2 5.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 64.14 110.875 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.9 tp -67.9 -12.28 60.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.129 -0.487 . . . . 70.44 110.893 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt 57.58 23.32 9.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 73.11 110.903 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -65.3 -179.73 0.64 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.437 . . . . 64.41 111.092 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 86.2 m -145.12 110.94 5.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.1 111.146 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 62.1 t -57.59 126.76 15.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 75.43 111.122 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 82.5 mt -110.72 -48.21 3.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 72.55 110.923 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -144.27 168.89 18.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 63.45 111.133 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 84.5 p -169.48 143.67 2.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 61.42 110.893 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 64.33 110.883 -179.963 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 N-CA-C 112.47 -0.252 . . . . 51.4 112.47 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 93.2 m -119.4 113.35 20.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 74.44 111.161 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -98.2 123.2 42.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 75.14 111.127 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -111.48 112.35 24.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 71.34 110.92 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.45 111.48 23.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.112 -0.495 . . . . 75.03 111.144 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -130.04 142.93 50.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.945 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.6 135.79 35.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 61.01 110.863 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -144.37 170.88 15.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 62.23 111.044 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -62.32 160.55 31.68 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.671 0.748 . . . . 74.21 110.87 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -19.7 35.76 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.717 2.278 . . . . 74.22 112.337 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -64.99 -46.85 79.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 75.32 110.904 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 54.1 t -64.32 121.79 14.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 73.42 111.122 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -117.28 177.26 4.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 75.54 110.91 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 83.3 t -52.15 -48.47 42.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 74.42 111.153 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -52.35 -43.88 64.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 71.53 110.87 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 38.6 m -66.84 -41.96 86.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.48 . . . . 74.25 111.171 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 6.7 mt -63.57 -50.88 67.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.956 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 27.6 ptt180 -64.64 -35.96 82.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 65.12 110.89 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -64.7 -45.57 86.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.169 -0.469 . . . . 74.05 110.843 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -70.03 -35.98 74.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.902 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 26.4 mt -63.6 -52.79 59.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 74.5 110.929 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -68.23 -38.0 81.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 71.14 110.891 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.22 -45.76 92.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 74.42 110.868 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -68.57 -23.68 64.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 75.01 110.87 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.08 -19.07 18.24 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.694 -0.765 . . . . 73.42 112.475 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -64.7 160.24 55.16 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.648 0.737 . . . . 74.42 110.86 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 97.43 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.705 2.27 . . . . 71.43 112.34 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -111.56 -35.03 1.96 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.728 -0.749 . . . . 72.51 112.474 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -64.66 -51.88 60.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.736 0.303 . . . . 73.53 110.906 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -71.66 -33.24 68.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 63.41 110.851 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -64.44 170.83 3.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.169 -0.469 . . . . 72.4 111.082 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.0 111.67 26.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 70.24 111.162 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 44.4 mt -97.53 119.89 46.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 73.15 111.164 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.24 155.43 27.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 73.24 111.128 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -114.71 142.24 46.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 63.11 110.902 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 61.8 t -134.55 113.42 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 75.05 111.156 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.19 102.18 1.63 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.135 -0.484 . . . . 75.22 110.887 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -74.0 160.27 82.15 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.616 0.722 . . . . 71.42 111.091 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.83 74.6 1.31 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.661 2.241 . . . . 75.42 112.335 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t 179.59 141.45 0.13 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 70.54 111.14 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -96.03 26.64 4.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 74.01 111.095 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.56 -35.06 3.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 71.44 111.083 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -140.03 178.57 7.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.441 . . . . 70.15 110.91 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 47.8 mtm180 -149.73 157.23 43.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 72.3 110.875 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -94.1 152.65 18.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 73.24 110.875 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -139.76 129.72 24.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 64.51 110.873 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.41 109.01 20.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.186 -0.461 . . . . 74.24 110.944 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.6 t -96.09 115.47 35.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 72.13 111.137 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -94.97 107.44 19.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.158 -0.474 . . . . 72.23 110.895 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.8 mt -132.36 154.29 81.53 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.625 0.726 . . . . 74.23 110.934 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 162.12 43.31 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.704 2.269 . . . . 75.24 112.35 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 104.16 1.29 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.664 2.243 . . . . 73.11 112.326 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.2 mt -104.36 -171.3 1.9 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 73.05 110.943 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 30.5 m -70.24 150.87 45.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 72.22 110.841 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -52.29 -47.32 65.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 61.24 110.858 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -60.91 -49.95 75.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 73.34 110.878 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -55.24 -55.5 30.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 71.14 110.834 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 71.8 mtp180 -53.2 -52.99 57.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.467 . . . . 72.44 110.894 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 -35.2 72.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.191 -0.459 . . . . 74.32 110.907 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -65.92 -45.63 81.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 73.12 110.868 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 22.8 tp -63.38 -51.07 67.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.114 -0.494 . . . . 73.13 110.912 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -57.36 -50.02 74.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 75.21 110.893 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -57.96 -53.5 57.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.467 . . . . 74.42 110.853 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.0 tt -52.68 -43.23 65.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 75.32 110.898 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.66 -56.54 20.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 75.43 110.876 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.36 -13.32 60.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 72.44 111.09 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 25.1 t -79.64 -57.29 3.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 62.31 110.85 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -88.33 -52.29 5.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 60.21 110.912 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.77 -12.44 60.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 73.12 110.966 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm 57.49 23.26 8.92 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.461 . . . . 71.45 110.882 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.29 178.7 1.43 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 63.22 111.142 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 42.4 m -143.89 110.98 5.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 73.4 111.144 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.9 t -58.18 104.01 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 74.22 111.145 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 25.1 mt -81.49 -39.08 25.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 73.02 110.926 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.59 173.2 13.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 74.45 111.083 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 1.3 t -166.06 155.81 12.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 72.45 110.87 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.47 . . . . 74.52 110.884 -179.972 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 N-CA-C 112.503 -0.239 . . . . 54.31 112.503 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 92.1 m -122.04 110.72 16.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.8 0.333 . . . . 74.43 111.168 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.6 142.6 27.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 74.41 111.069 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -133.89 108.92 8.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 73.32 110.899 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 2.5 m -93.96 119.19 32.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 74.21 111.185 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -131.3 156.55 45.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 74.15 110.93 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -106.17 150.07 26.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 75.54 110.839 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -157.31 171.69 19.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 63.11 111.088 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.24 160.6 56.57 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.653 0.739 . . . . 72.42 110.881 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 -15.23 36.72 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.663 2.242 . . . . 72.21 112.338 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -62.82 -50.74 69.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.219 -0.446 . . . . 73.41 110.872 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.36 148.64 6.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 74.52 111.112 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -137.32 172.97 12.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.484 . . . . 73.45 110.875 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 87.2 t -51.41 -50.01 29.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 71.4 111.1 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -53.27 -40.39 64.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 73.44 110.918 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.4 m -68.36 -41.4 80.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 53.21 111.106 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 6.6 mt -60.51 -51.24 70.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.243 -0.435 . . . . 74.02 110.921 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -64.73 -42.95 94.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 74.41 110.902 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -59.85 -38.05 81.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.466 . . . . 75.25 110.835 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -72.04 -44.61 63.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 73.13 110.863 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 40.1 mt -57.02 -48.89 77.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.464 . . . . 72.13 110.939 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -71.5 -37.99 71.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 75.14 110.88 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -55.28 -49.19 72.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 65.43 110.868 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.35 -25.92 67.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.468 . . . . 72.0 110.939 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 112.44 -7.29 26.5 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.748 -0.739 . . . . 64.22 112.495 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -71.45 160.31 82.95 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.656 0.741 . . . . 72.12 110.87 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 79.93 0.91 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.667 2.245 . . . . 72.42 112.368 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -95.81 -37.18 5.05 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.748 -0.739 . . . . 73.12 112.47 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 11.5 pttp -59.34 -43.62 92.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.771 0.319 . . . . 75.14 110.875 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -81.18 -33.31 33.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 74.41 110.846 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -54.87 169.64 0.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 61.35 111.107 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 34.0 t -127.11 110.83 23.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 74.43 111.144 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 56.5 mt -92.91 128.76 44.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 74.2 111.12 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.95 136.54 52.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 72.35 111.138 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -99.16 132.93 44.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 74.41 110.881 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 33.1 t -139.54 111.42 5.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 72.33 111.105 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.78 98.52 8.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 75.25 110.896 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -65.08 161.22 50.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.609 0.718 . . . . 74.21 111.112 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 71.13 1.52 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.699 2.266 . . . . 74.14 112.372 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.8 t 177.81 136.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 74.55 111.161 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -93.96 38.63 1.08 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 73.23 111.064 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -124.42 -35.28 2.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 73.44 111.092 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -139.85 177.26 8.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.277 -0.42 . . . . 74.54 110.906 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.45 152.65 44.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 65.2 110.911 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -111.67 130.97 55.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 75.34 110.876 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -132.93 135.41 45.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 74.23 110.87 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -103.92 112.22 25.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 73.54 110.893 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 14.5 t -95.28 111.08 25.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 72.3 111.141 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -87.76 115.18 25.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 72.42 110.904 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.1 mt -131.78 154.88 81.92 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.644 0.735 . . . . 74.21 110.899 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 162.73 40.92 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.707 2.271 . . . . 65.31 112.379 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 103.91 1.23 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.698 2.266 . . . . 70.35 112.392 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.0 mt -107.22 -170.96 1.79 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 73.51 110.935 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.3 t -71.83 150.43 44.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 64.12 110.874 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -48.92 64.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 64.54 110.904 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -60.55 -48.41 81.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.888 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 49.4 mmm-85 -54.47 -57.96 9.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 73.21 110.885 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -52.86 -52.58 56.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 74.33 110.908 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mt -56.36 -37.12 69.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 71.0 110.928 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -64.84 -46.16 83.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 72.31 110.872 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 24.9 tp -60.91 -51.13 70.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 74.15 110.907 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.36 -50.33 73.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 73.45 110.857 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -58.0 -51.88 67.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.14 110.867 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.6 tt -52.83 -44.78 66.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.229 -0.441 . . . . 74.01 110.88 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -60.05 -56.42 21.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 74.21 110.898 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.23 -13.14 59.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 74.03 111.103 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 23.2 t -79.63 -57.77 3.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 75.31 110.803 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -88.42 -52.12 5.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.093 -0.503 . . . . 75.43 110.874 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.82 -12.51 60.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.32 110.912 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt 57.09 23.39 8.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.185 -0.462 . . . . 74.35 110.924 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -68.65 176.93 2.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 72.13 111.071 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.7 m -145.09 110.96 5.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 73.32 111.098 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.5 t -54.14 135.11 16.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 74.15 111.1 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 77.6 mt -120.79 -47.64 2.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 71.25 110.877 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -133.88 165.84 24.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 71.02 111.069 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 80.3 p -171.69 138.48 1.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 62.12 110.84 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.33 110.888 -179.971 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 N-CA-C 112.476 -0.249 . . . . 71.23 112.476 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 94.4 m -128.72 110.26 12.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.746 0.308 . . . . 74.12 111.154 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -96.81 130.1 44.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 74.11 111.094 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -117.56 116.45 27.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.217 -0.447 . . . . 75.41 110.923 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -98.81 110.04 22.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 72.1 111.158 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -133.37 145.64 50.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 71.43 110.89 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -89.29 137.72 32.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 75.23 110.911 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -133.27 167.09 21.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 74.23 111.097 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -65.35 160.61 57.32 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.667 0.746 . . . . 71.43 110.862 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -12.79 33.6 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 2.251 . . . . 70.03 112.334 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -81.78 -37.29 27.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 73.44 110.861 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 87.8 t -70.75 120.67 19.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 63.22 111.143 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -113.49 178.72 4.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 74.14 110.883 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 54.1 t -53.46 -48.66 57.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 75.45 111.146 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -51.88 -42.08 62.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 71.31 110.875 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 69.6 m -67.84 -39.97 83.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.476 . . . . 71.45 111.139 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 2.3 mt -61.87 -50.94 70.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 70.22 110.899 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -64.79 -42.21 95.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.459 . . . . 75.25 110.859 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -60.04 -40.51 89.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.43 110.885 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -70.9 -43.27 68.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 74.04 110.871 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 34.1 mt -57.78 -49.52 76.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 72.12 110.881 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.79 -37.96 73.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 75.0 110.872 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -56.38 -49.18 75.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.3 110.865 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -24.52 65.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 74.51 110.914 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -16.88 20.23 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.755 -0.736 . . . . 53.51 112.491 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -60.94 160.24 21.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.658 0.742 . . . . 74.3 110.876 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 86.42 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.724 2.283 . . . . 74.12 112.333 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -102.04 -30.54 5.69 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.747 -0.739 . . . . 72.22 112.452 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -63.94 -42.22 97.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.766 0.317 . . . . 74.21 110.871 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -85.53 -27.19 25.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 74.41 110.854 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -62.34 165.6 5.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 62.44 111.104 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.83 111.28 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 73.5 111.092 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 54.3 mt -92.8 139.5 17.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 73.44 111.128 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -135.47 143.68 45.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 73.03 111.122 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -99.3 143.23 29.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 74.31 110.883 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 76.8 t -139.01 115.11 9.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.452 . . . . 74.42 111.119 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -74.63 127.3 32.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 74.14 110.868 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -110.41 160.22 29.25 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.563 0.697 . . . . 70.53 111.135 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 74.48 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.692 2.262 . . . . 72.44 112.356 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.0 t 179.17 141.58 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.462 . . . . 73.34 111.122 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -99.56 27.41 5.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 71.04 111.089 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.48 -35.02 3.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 73.11 111.068 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -146.8 159.98 42.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.275 -0.421 . . . . 75.12 110.943 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 4.6 ptt180 -131.18 165.02 24.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.09 -0.505 . . . . 74.03 110.867 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -92.84 139.94 30.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 64.02 110.869 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -128.83 122.86 31.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.486 . . . . 73.54 110.851 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.31 105.54 16.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.104 -0.498 . . . . 75.43 110.916 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.4 t -96.82 133.52 37.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 75.05 111.084 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 18.9 tttp -108.55 108.1 18.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 72.41 110.929 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.6 mt -131.17 154.44 81.99 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.577 0.703 . . . . 75.52 110.898 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.16 43.14 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.678 2.252 . . . . 72.51 112.383 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 113.92 3.53 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.637 2.224 . . . . 74.41 112.354 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 1.2 mt -115.37 -171.19 1.91 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 74.55 110.907 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.32 154.98 38.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 73.23 110.848 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . 0.479 ' N ' HH21 ' A' ' 537' ' ' ARG . 4.6 m-20 -51.67 -47.11 63.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.101 -0.5 . . . . 75.13 110.855 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -59.78 -50.17 74.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 71.31 110.863 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -50.88 -59.11 4.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 72.31 110.897 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . 0.479 HH21 ' N ' ' A' ' 534' ' ' ASP . 79.4 mtm180 -53.51 -52.51 59.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 72.31 110.864 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.38 -39.32 67.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 73.24 110.931 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -67.23 -47.34 71.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.467 . . . . 72.43 110.879 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -60.01 -51.09 71.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.14 110.92 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -59.47 -48.33 82.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 74.23 110.939 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 23.8 mtp180 -60.13 -53.52 56.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 73.51 110.869 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 4.0 tt -52.9 -44.03 66.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 74.34 110.902 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.39 -56.48 20.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 74.35 110.875 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.36 -13.2 60.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 72.53 111.103 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.52 -57.34 3.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 73.11 110.898 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -88.33 -52.24 5.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.495 . . . . 71.11 110.914 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.1 tp -67.88 -12.35 60.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 74.34 110.945 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt 57.44 23.22 8.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 73.22 110.893 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.99 179.44 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 63.41 111.113 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 61.5 m -139.67 110.99 7.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 72.11 111.188 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.41 114.52 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 74.11 111.145 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 12.2 mt -90.92 -51.66 5.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 75.14 110.856 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -162.0 174.21 13.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.11 111.092 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 90.7 p -163.06 148.43 11.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 74.31 110.887 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 70.03 110.889 -179.965 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.478 -0.249 . . . . 75.42 112.478 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 25.6 m -131.6 107.35 8.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.8 0.333 . . . . 73.22 111.162 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.0 115.15 27.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 74.03 111.084 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -104.69 113.03 26.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 74.42 110.93 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 5.2 m -94.87 110.09 22.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.129 -0.487 . . . . 72.32 111.127 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -134.41 143.28 47.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 71.41 110.939 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 24.3 mtp180 -90.21 142.15 28.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 74.42 110.834 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -137.15 168.54 19.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.172 -0.467 . . . . 73.13 111.065 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -63.94 160.57 45.67 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.617 0.722 . . . . 64.02 110.908 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -14.12 35.49 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.666 2.244 . . . . 75.43 112.322 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -80.17 -37.33 33.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 73.15 110.904 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 63.9 t -69.2 125.64 27.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.453 . . . . 74.12 111.169 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -117.99 175.35 5.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 74.41 110.873 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 60.9 t -51.79 -48.9 37.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 74.34 111.114 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -52.0 -40.38 60.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 54.15 110.918 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 95.2 m -66.47 -43.23 86.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.134 -0.485 . . . . 75.34 111.111 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 7.2 mt -61.78 -51.04 69.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 71.35 110.924 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -65.02 -35.09 80.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 74.15 110.841 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 42.6 mtp180 -64.19 -45.09 89.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.244 -0.435 . . . . 74.31 110.859 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -71.15 -36.92 72.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 71.22 110.9 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 29.2 mt -62.11 -50.43 71.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.962 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -71.08 -37.87 72.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 70.24 110.873 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.09 -48.95 78.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 73.45 110.905 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -67.88 -24.05 65.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 72.55 110.865 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 113.91 -18.6 19.11 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.745 -0.741 . . . . 63.01 112.472 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -60.74 160.24 20.92 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.684 0.754 . . . . 74.11 110.884 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 90.08 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.683 2.255 . . . . 61.2 112.362 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -104.95 -39.26 2.35 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.788 -0.72 . . . . 61.12 112.501 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 17.1 mtpp -57.25 -52.08 66.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.728 0.299 . . . . 75.41 110.883 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.14 -36.27 66.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.426 . . . . 71.42 110.893 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -54.14 167.06 0.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 73.43 111.1 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.72 111.12 24.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 72.1 111.163 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 74.7 mt -96.02 127.05 48.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 72.34 111.141 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 2.1 m -122.13 148.21 45.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 74.3 111.193 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -104.41 140.35 38.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 72.34 110.925 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 80.8 t -136.43 111.91 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 65.04 111.177 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.09 110.93 7.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 74.33 110.924 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -91.51 160.25 37.16 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.547 0.689 . . . . 73.52 111.104 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 74.55 1.29 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.673 2.249 . . . . 75.31 112.346 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.9 t -177.04 137.37 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 73.32 111.149 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.42 25.8 4.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 75.23 111.101 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.38 -35.15 3.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 64.34 111.072 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -144.58 166.77 24.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 72.2 110.906 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -136.32 160.23 39.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.492 . . . . 75.33 110.853 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -88.97 138.39 31.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 53.55 110.906 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -128.76 122.2 30.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 63.44 110.881 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.3 104.82 16.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 75.44 110.905 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.6 t -96.57 111.86 27.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 71.23 111.112 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 17.3 ttmt -91.38 109.05 20.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.15 110.86 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.0 mt -132.53 154.42 81.52 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.618 0.723 . . . . 74.35 110.921 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 162.19 43.04 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.714 2.276 . . . . 72.52 112.349 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 103.88 1.23 Allowed 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.684 2.256 . . . . 74.02 112.344 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 5.0 mt -101.06 -171.34 1.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 74.21 110.884 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 30.0 t -71.12 151.25 44.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 73.35 110.875 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -51.75 -51.14 58.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 63.41 110.873 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -61.14 -45.41 94.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.436 . . . . 72.11 110.924 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 11.6 mmt180 -57.38 -58.07 9.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 74.34 110.87 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -52.82 -52.15 58.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 73.4 110.908 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.4 mt -56.86 -48.12 78.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 73.32 110.9 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.8 -41.63 74.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 74.22 110.908 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 34.5 tp -66.38 -39.71 89.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.136 -0.484 . . . . 75.04 110.904 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -61.23 -55.4 32.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 75.51 110.836 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 1.6 ptt85 -59.07 -47.83 83.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 75.22 110.849 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 5.5 tt -53.59 -47.34 70.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.439 . . . . 75.5 110.898 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -60.63 -56.04 26.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 73.34 110.867 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.48 -14.09 55.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 75.13 111.138 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.03 -59.28 2.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 75.43 110.798 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -86.23 -52.55 5.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 74.43 110.87 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.53 -12.67 60.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.456 . . . . 71.42 110.93 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.27 23.2 8.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 72.13 110.9 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -68.68 175.4 3.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 71.41 111.075 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 88.9 m -137.55 111.18 8.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 74.43 111.148 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.2 111.81 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 73.44 111.167 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 12.1 mt -90.15 -51.96 5.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 63.12 110.881 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.4 175.12 13.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 75.21 111.09 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 91.9 p -163.72 139.34 6.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 70.32 110.837 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 73.52 110.843 -179.93 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.498 -0.241 . . . . 52.33 112.498 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 1.6 m -123.94 109.21 13.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.776 0.322 . . . . 74.54 111.175 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.87 121.98 37.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 73.42 111.103 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -115.95 114.6 24.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.439 . . . . 72.31 110.934 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -100.06 113.55 26.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.095 -0.502 . . . . 75.41 111.158 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -131.64 143.86 50.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 75.34 110.861 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -92.14 145.25 24.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.467 . . . . 73.01 110.846 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -148.66 169.76 19.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 73.21 111.139 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -64.97 160.8 52.97 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.657 0.741 . . . . 75.51 110.925 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -10.74 29.3 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.691 2.261 . . . . 74.45 112.385 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -73.85 -46.45 44.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 71.54 110.853 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 67.0 t -66.92 138.86 22.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.11 111.121 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -133.73 179.71 6.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 64.2 110.903 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.6 t -51.54 -47.93 36.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 72.23 111.093 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -51.65 -39.99 59.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.4 110.879 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.2 m -71.31 -35.53 71.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 70.13 111.141 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 4.1 mt -67.32 -45.57 76.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 75.13 110.898 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -69.47 -46.26 67.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 74.22 110.898 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -64.12 -32.47 74.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 73.32 110.891 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -73.28 -46.99 46.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 72.12 110.85 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 43.4 mt -61.08 -42.53 98.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 75.03 110.941 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -73.05 -37.59 66.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 73.05 110.891 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -60.34 -48.98 79.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 72.4 110.88 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -68.97 -23.78 64.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 72.34 110.875 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.12 -17.6 19.41 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.746 -0.74 . . . . 70.45 112.493 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -63.05 160.16 41.11 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.593 0.711 . . . . 75.21 110.943 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 95.57 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 122.689 2.259 . . . . 65.54 112.325 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -111.15 -37.24 1.68 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.695 -0.764 . . . . 74.43 112.482 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -63.34 -42.56 98.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.791 0.329 . . . . 65.23 110.874 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -79.91 -38.43 32.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 73.42 110.938 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -55.94 171.44 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 73.43 111.115 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 56.4 t -127.08 118.08 49.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.272 -0.422 . . . . 75.02 111.159 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 50.7 mt -96.82 141.84 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 74.33 111.151 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.89 138.72 37.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.13 111.173 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.53 143.17 27.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 53.13 110.956 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 83.7 t -135.77 104.61 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 75.23 111.11 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 18.9 tm0? -73.84 102.08 3.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 75.51 110.894 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -81.92 160.23 63.98 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.595 0.712 . . . . 75.12 111.089 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 74.55 1.29 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.629 2.22 . . . . 71.24 112.356 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 4.4 t -175.05 139.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 72.23 111.187 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.63 25.18 6.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 72.35 111.083 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.85 -34.57 3.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 73.13 111.11 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -138.6 177.61 7.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.242 -0.435 . . . . 74.21 110.944 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 44.2 mtt85 -144.78 153.66 41.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 75.51 110.875 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -92.27 138.74 31.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 71.45 110.878 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -122.25 122.77 39.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.138 -0.483 . . . . 75.22 110.868 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.46 101.48 12.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.15 110.944 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 19.7 t -95.98 122.7 47.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 74.32 111.128 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.63 109.65 21.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.478 . . . . 74.21 110.874 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.8 mt -130.77 154.65 81.9 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.583 0.706 . . . . 75.35 110.915 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 162.41 42.18 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.66 2.24 . . . . 62.14 112.379 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 104.04 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.667 2.245 . . . . 75.32 112.346 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.6 mt -103.0 -171.0 1.87 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 73.14 110.895 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 21.3 m -75.69 152.59 37.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 64.32 110.853 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.64 -46.77 63.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 75.24 110.918 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.03 -43.1 99.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 74.32 110.915 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -62.0 -55.8 25.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 75.34 110.877 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 45.9 mtp180 -52.79 -53.15 52.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 74.23 110.895 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -48.3 74.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 73.53 110.975 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -55.55 -41.84 73.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.23 110.948 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 30.4 tp -66.0 -39.2 90.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.082 -0.508 . . . . 74.42 110.901 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -61.74 -55.63 28.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.185 -0.461 . . . . 75.41 110.919 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -58.55 -47.95 82.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.096 -0.502 . . . . 75.21 110.89 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 12.2 mt -53.72 -47.92 70.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 73.22 110.945 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -59.62 -56.26 24.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.166 -0.47 . . . . 74.22 110.877 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.06 -13.54 58.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 74.34 111.082 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -59.03 2.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.889 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -88.2 -52.22 5.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 72.42 110.896 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.63 -12.73 61.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 73.55 110.991 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt 55.89 24.22 7.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 74.33 110.942 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.81 -179.94 3.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.232 -0.44 . . . . 72.33 111.104 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.7 m -145.05 111.37 5.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 74.3 111.096 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.5 t -52.08 120.23 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 65.02 111.138 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 16.0 mt -99.0 -50.91 4.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 72.41 110.88 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -159.11 174.71 14.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.447 . . . . 72.54 111.131 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 51.1 p -161.04 163.51 31.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 63.0 110.857 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 73.22 110.88 -179.973 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.471 -0.251 . . . . 63.22 112.471 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 9.3 m -125.17 113.65 17.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.811 0.339 . . . . 72.11 111.133 -179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.06 121.18 36.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 65.12 111.096 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -114.01 110.18 19.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 72.34 110.921 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.5 m -97.77 120.21 37.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 72.24 111.123 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -136.96 153.2 50.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 72.52 110.888 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 2.5 ttm180 -98.89 137.87 36.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.454 . . . . 70.32 110.864 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -146.52 168.06 22.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 75.44 111.104 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.56 160.75 49.76 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.608 0.718 . . . . 72.55 110.9 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -15.86 37.08 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.653 2.235 . . . . 75.43 112.322 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -66.64 -47.48 72.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 74.03 110.847 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 38.7 t -67.87 129.63 32.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 73.34 111.123 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -122.6 177.77 5.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 75.45 110.844 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 87.1 t -51.5 -49.53 32.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 74.24 111.132 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -50.78 -40.36 54.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 73.53 110.841 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 91.5 m -70.57 -35.14 72.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 73.24 111.137 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 4.5 mt -68.02 -44.19 77.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 73.01 110.887 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -69.39 -45.04 70.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.916 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -66.48 -32.78 74.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 74.44 110.876 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -73.6 -42.67 61.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.916 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 52.9 mt -65.53 -41.56 92.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 72.23 110.934 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -73.07 -37.76 66.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.41 110.88 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -64.02 -46.32 84.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 74.53 110.877 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -65.88 -24.76 66.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 73.22 110.941 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.01 -16.06 20.73 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.717 -0.754 . . . . 74.22 112.487 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -71.94 160.27 83.15 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.66 0.743 . . . . 74.44 110.877 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 98.44 0.69 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.676 2.25 . . . . 61.12 112.313 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -116.27 -34.59 1.31 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.779 -0.724 . . . . 62.52 112.495 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 3.7 mtmp? -62.39 -50.56 71.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.779 0.323 . . . . 72.35 110.907 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -73.02 -32.85 65.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 73.32 110.897 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -59.75 172.94 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.138 -0.483 . . . . 73.35 111.097 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.03 119.37 52.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.225 -0.443 . . . . 74.23 111.145 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 44.2 mt -99.28 141.9 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 74.44 111.141 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.06 134.3 36.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 75.32 111.128 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 12.5 pm0 -94.89 142.74 27.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 72.2 110.949 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.8 t -138.21 114.33 10.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 74.34 111.183 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.08 113.01 10.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 75.1 110.88 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -91.76 160.34 36.43 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.616 0.722 . . . . 54.44 111.055 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 74.43 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.673 2.249 . . . . 75.53 112.375 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 3.0 t -179.32 141.02 0.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 73.55 111.145 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -97.33 24.76 6.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.253 -0.431 . . . . 65.22 111.125 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.63 -35.67 2.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 71.03 111.041 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -137.58 168.14 20.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 74.21 110.887 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 10.6 mmt85 -140.67 160.03 40.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.094 -0.503 . . . . 75.15 110.884 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -90.52 139.48 30.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 64.41 110.89 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -128.47 124.63 36.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.486 . . . . 74.21 110.859 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.35 104.31 13.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.465 . . . . 74.04 110.907 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.86 127.04 49.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 71.33 111.154 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -106.44 108.32 19.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 54.21 110.885 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.3 mt -130.58 154.73 81.76 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.631 0.729 . . . . 73.34 110.873 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 162.39 42.28 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.675 2.25 . . . . 74.02 112.331 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 104.05 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.701 2.267 . . . . 53.32 112.337 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.7 mt -103.78 -170.9 1.84 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 63.12 110.961 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 32.5 t -72.98 151.09 41.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 71.32 110.865 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.06 -46.31 65.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 51.52 110.82 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -61.11 -53.55 55.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 72.2 110.888 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 42.2 mmt180 -52.04 -55.79 18.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.458 . . . . 75.22 110.885 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 -52.93 -53.2 52.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 65.03 110.878 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.2 -39.8 70.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 74.14 110.933 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -64.21 -42.17 96.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.48 . . . . 74.54 110.885 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 22.7 tp -64.01 -51.17 65.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.871 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -57.28 -50.79 71.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 74.3 110.872 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -57.92 -52.52 65.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 74.33 110.881 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.5 mt -52.75 -43.5 65.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 73.12 110.925 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -60.86 -56.6 19.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 73.52 110.858 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.09 -13.45 60.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 74.22 111.091 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.7 -57.78 3.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.217 -0.447 . . . . 72.43 110.89 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -88.41 -52.32 5.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 62.41 110.863 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.71 -12.67 61.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 74.33 110.913 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 57.04 23.33 8.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 75.43 110.915 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -69.32 179.68 1.92 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 73.24 111.119 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 3.0 m -144.09 110.94 5.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 75.53 111.13 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 39.2 t -53.64 115.59 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 75.41 111.092 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 72.1 mt -92.51 -45.7 8.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 75.22 110.955 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.11 174.58 12.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 72.53 111.087 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 63.7 p -169.05 149.85 4.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 71.22 110.852 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 75.51 110.91 -179.986 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 22.3 mtp . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.814 0.34 . . . . 71.21 110.893 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 7.2 p -159.68 135.85 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 75.34 111.115 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -109.38 172.4 16.1 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.706 -0.759 . . . . 73.25 112.469 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -133.12 145.95 51.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.895 0.379 . . . . 74.34 110.861 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -139.65 153.55 47.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 74.35 110.918 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -99.84 127.01 46.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 74.35 110.92 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 3.7 m -128.14 177.09 7.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 63.31 110.871 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 59.7 mt -101.45 142.14 16.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 73.15 111.085 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -161.95 115.71 1.86 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 74.41 110.886 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -57.94 -27.86 63.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 73.5 110.894 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -86.47 171.63 10.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 75.02 111.146 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 164.24 99.01 0.13 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.755 -0.736 . . . . 64.23 112.544 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -143.23 136.45 7.02 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.768 -0.73 . . . . 70.23 112.518 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 82.1 m -129.34 110.61 12.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.802 0.334 . . . . 73.14 111.175 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -97.38 112.19 24.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 73.34 111.138 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -101.29 118.59 37.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 71.05 110.93 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -101.44 112.84 25.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 65.11 111.149 -179.972 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -132.6 142.91 49.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.256 -0.429 . . . . 74.35 110.922 179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.42 146.02 24.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 70.1 110.875 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -151.35 167.35 28.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 71.32 111.091 179.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -61.04 160.48 21.11 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.623 0.725 . . . . 73.33 110.875 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -23.61 30.6 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.689 2.259 . . . . 71.41 112.317 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 32.9 m-20 -63.56 -35.06 79.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 73.02 110.916 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 46.5 t -73.81 132.94 32.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.475 . . . . 75.23 111.136 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -127.88 177.67 6.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 74.34 110.879 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 91.1 t -51.72 -42.14 30.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 72.31 111.119 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -58.54 -41.21 85.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 73.54 110.892 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 34.8 m -66.31 -44.49 83.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 75.42 111.132 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 7.4 mt -62.03 -51.0 69.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 75.14 110.914 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -64.32 -34.83 79.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 75.0 110.858 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -64.71 -46.38 82.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 73.41 110.89 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -70.27 -35.41 73.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 75.11 110.839 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 36.4 mt -63.61 -52.81 59.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 74.32 110.922 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.78 -37.96 79.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 73.11 110.919 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -59.32 -48.27 82.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.487 . . . . 74.24 110.902 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -66.66 -24.85 66.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 73.44 110.897 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -18.35 18.99 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.74 -0.743 . . . . 75.25 112.505 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -62.21 160.25 32.95 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.657 0.741 . . . . 75.34 110.894 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 90.3 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.653 2.235 . . . . 74.22 112.335 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -107.46 -26.08 5.79 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.702 -0.761 . . . . 71.54 112.478 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -68.05 -51.94 41.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 71.15 110.891 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -75.22 -33.9 61.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 74.2 110.867 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -55.92 170.56 0.29 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 73.12 111.093 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.01 113.35 32.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.232 -0.44 . . . . 73.44 111.101 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 57.9 mt -100.05 126.74 53.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 73.3 111.128 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -125.03 148.7 48.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 74.04 111.181 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -101.25 143.63 31.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 74.44 110.878 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 90.2 t -133.07 103.62 6.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 75.43 111.133 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -68.51 99.22 0.94 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 75.24 110.916 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -76.58 160.19 77.74 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.697 . . . . 74.53 111.07 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 74.5 1.27 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.696 2.264 . . . . 72.21 112.369 179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 4.7 t -177.68 138.88 0.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.201 -0.454 . . . . 64.53 111.157 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.73 26.14 4.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.252 -0.431 . . . . 74.33 111.087 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.86 -35.23 3.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 75.53 111.13 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -141.08 177.15 8.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 74.43 110.914 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -147.76 154.01 39.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.072 -0.513 . . . . 75.25 110.847 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -89.02 145.94 25.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 73.23 110.936 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -129.87 124.34 32.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 72.42 110.919 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -102.64 105.87 16.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 71.34 110.906 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.6 t -96.26 125.66 49.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 70.22 111.161 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 6.0 ttmm -104.63 107.18 18.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 75.22 110.895 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.1 mt -132.3 154.54 81.64 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 74.53 110.897 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 162.08 43.48 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.686 2.257 . . . . 74.24 112.315 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 104.36 1.31 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.669 2.246 . . . . 73.42 112.338 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.0 mt -105.32 -171.07 1.85 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 70.14 110.944 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 9.3 t -72.35 153.12 41.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 73.52 110.883 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -52.08 -44.46 64.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 70.43 110.88 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -60.48 -38.97 85.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.246 -0.434 . . . . 75.24 110.933 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -66.05 -53.22 41.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 73.4 110.856 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 -55.52 -45.54 77.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 71.52 110.868 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mt -69.06 -38.88 79.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 64.23 110.957 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -63.75 -47.03 82.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 54.03 110.908 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 26.1 tp -66.1 -51.14 60.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 75.31 110.945 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -58.23 -49.78 75.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 75.2 110.913 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 8.3 mmt85 -58.39 -53.5 57.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 73.32 110.881 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 10.3 mt -52.7 -43.72 65.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.215 -0.448 . . . . 73.0 110.895 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.3 -56.48 21.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 74.4 110.889 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.46 -13.31 60.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 62.45 111.115 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 22.5 t -79.51 -56.97 3.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.894 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -88.38 -52.18 5.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 74.52 110.902 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.3 tp -67.86 -12.37 60.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.161 -0.472 . . . . 75.21 110.909 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 57.63 23.38 9.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.22 -0.445 . . . . 71.2 110.852 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -65.08 179.84 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 74.41 111.114 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 19.4 m -145.13 110.94 5.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 75.42 111.142 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.4 t -59.01 108.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 74.15 111.135 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 63.8 mt -89.71 -42.23 11.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 72.44 110.898 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -158.55 175.08 14.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 75.13 111.112 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 95.2 p -171.98 145.87 1.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 73.25 110.869 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -137.98 147.47 44.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.1 110.861 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 32.2 m -139.43 142.37 37.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 64.24 111.095 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 23.3 t -105.85 100.84 11.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 75.03 111.162 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 C-N-CA 120.729 -0.748 . . . . 74.0 112.514 179.997 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 11.6 ttt . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.856 0.36 . . . . 73.04 110.877 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 60.0 t -90.07 -57.31 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.19 -0.459 . . . . 73.02 111.108 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 176.4 169.59 38.02 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.707 -0.758 . . . . 73.13 112.473 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -106.98 -179.77 4.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.857 0.36 . . . . 72.22 110.884 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -133.45 145.95 50.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.142 -0.481 . . . . 74.2 110.899 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -121.15 27.09 8.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 74.15 110.884 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 1.4 t -95.0 177.24 5.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.476 . . . . 64.2 110.851 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 24.2 pt -70.17 178.45 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 65.43 111.127 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -125.47 79.7 1.83 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.169 -0.469 . . . . 73.43 110.878 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -172.24 139.56 1.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.848 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 4.6 m -95.59 144.6 25.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.153 -0.476 . . . . 73.14 111.135 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -155.93 -115.81 0.52 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.75 -0.738 . . . . 63.14 112.516 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 156.01 145.22 4.13 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.7 -0.762 . . . . 53.43 112.446 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 21.2 m -124.86 107.5 10.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.794 0.33 . . . . 62.2 111.161 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.98 114.09 25.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 74.34 111.083 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -106.1 117.38 33.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 72.43 110.965 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.34 113.6 27.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 73.5 111.143 -179.941 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -129.14 142.38 50.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 74.42 110.909 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -90.3 130.56 36.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 74.31 110.833 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -133.94 169.42 17.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 74.13 111.127 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -60.49 160.55 17.88 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.652 0.739 . . . . 75.22 110.919 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -20.63 34.31 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.721 2.28 . . . . 72.01 112.302 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -67.97 -43.56 78.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 73.44 110.926 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 61.4 t -64.01 133.01 29.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.147 -0.479 . . . . 73.02 111.149 179.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -124.58 176.88 6.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 64.24 110.906 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 96.4 t -53.57 -50.02 52.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 75.23 111.108 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -52.05 -37.14 52.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 74.14 110.901 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 93.5 m -69.61 -41.83 75.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 64.21 111.188 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 8.0 mt -63.51 -49.83 72.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 75.41 110.956 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -65.87 -40.13 91.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 73.51 110.906 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -61.08 -45.48 94.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 74.52 110.878 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -69.5 -39.51 77.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 64.22 110.891 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 36.7 mt -58.86 -52.71 64.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 74.21 110.915 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -69.19 -37.96 78.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 75.44 110.873 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -56.18 -47.42 78.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 73.4 110.9 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -70.56 -22.71 62.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 71.54 110.913 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -17.86 19.43 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.739 -0.744 . . . . 73.12 112.519 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -61.3 160.22 25.06 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.614 0.721 . . . . 74.33 110.883 -179.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 93.2 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.671 2.247 . . . . 74.03 112.34 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.1 -38.12 1.28 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.699 -0.762 . . . . 64.14 112.434 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 7.9 pttt -60.53 -30.74 69.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.776 0.322 . . . . 74.52 110.906 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -95.52 -32.79 12.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.92 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -57.28 170.67 0.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 73.33 111.114 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 22.0 t -126.9 111.53 26.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 64.14 111.141 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 72.6 mt -100.53 137.48 27.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 74.4 111.108 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.76 138.48 39.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 74.12 111.118 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -83.96 140.48 31.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 75.12 110.893 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 67.6 t -131.82 100.38 4.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.192 -0.458 . . . . 74.23 111.125 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -67.53 112.1 4.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 72.44 110.915 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -94.51 160.26 31.99 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.619 0.723 . . . . 64.25 111.091 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.78 74.52 1.29 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.672 2.248 . . . . 72.23 112.374 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.0 t -176.43 137.48 0.28 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 71.4 111.096 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.4 25.15 4.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 61.12 111.087 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.99 -35.4 3.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 71.22 111.055 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -143.16 170.89 14.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 71.44 110.874 -179.784 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 60.5 mtt-85 -142.67 160.32 40.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 74.04 110.869 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -91.29 141.99 28.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 75.41 110.887 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -127.86 120.31 27.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 74.11 110.867 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -96.39 106.22 18.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 74.54 110.935 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 20.0 t -100.93 118.07 47.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 71.0 111.129 179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -96.6 107.45 19.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 75.42 110.91 179.907 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.3 mt -130.33 154.38 81.47 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.563 0.696 . . . . 74.11 110.93 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 162.15 43.2 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.675 2.25 . . . . 72.34 112.327 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 117.19 4.94 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.695 2.264 . . . . 70.02 112.299 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 2.5 mt -118.83 -170.96 2.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 74.44 110.91 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.1 t -67.23 148.16 52.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 74.2 110.844 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -51.91 -48.02 64.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 73.04 110.85 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -61.95 -44.53 96.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 71.42 110.86 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -61.07 -54.04 49.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.483 . . . . 75.31 110.903 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -54.14 -53.05 58.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.253 -0.431 . . . . 71.45 110.838 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -60.42 -40.0 89.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 75.14 110.902 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -63.25 -48.82 76.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 71.12 110.88 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 49.1 tp -59.01 -51.04 71.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 75.4 110.937 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -56.37 -48.81 76.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 74.34 110.892 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -63.82 -37.93 89.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 72.12 110.833 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 4.8 tt -60.27 -50.95 71.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 74.41 110.921 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 12.2 m-85 -63.35 -50.56 69.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 72.44 110.837 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -61.12 -27.49 68.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 70.04 111.066 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.7 t -80.71 -62.73 1.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.253 -0.431 . . . . 71.34 110.818 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -64.62 -59.44 4.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 64.41 110.88 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.7 tp -68.93 -8.58 45.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.138 -0.483 . . . . 74.1 110.941 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.71 22.56 11.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 75.42 110.901 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -73.84 179.6 4.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 70.11 111.091 179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.5 m -145.05 110.95 5.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 74.41 111.101 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 46.9 t -52.11 112.48 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 74.1 111.131 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 13.4 mt -88.58 -51.95 5.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.149 -0.478 . . . . 73.33 110.932 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.55 173.78 15.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 75.33 111.047 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 95.2 p -160.7 145.41 14.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 71.42 110.84 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -139.72 148.97 43.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.124 -0.489 . . . . 64.21 110.911 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 26.7 m -142.06 141.66 32.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 72.15 111.107 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 37.3 t -88.09 105.68 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 73.5 111.165 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 C-N-CA 120.714 -0.755 . . . . 64.42 112.492 -179.993 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.807 0.336 . . . . 72.33 110.864 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 36.0 m -83.2 -25.28 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 74.55 111.134 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 71.72 -126.02 12.02 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.748 -0.739 . . . . 75.33 112.491 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -140.32 -179.62 6.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.866 0.365 . . . . 74.33 110.883 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -109.72 -40.71 4.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 74.34 110.862 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 53.5 p90 -159.42 146.95 17.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.203 -0.453 . . . . 75.33 110.949 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 1.8 t -136.18 159.59 41.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 65.34 110.828 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 66.1 mt -103.12 140.9 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 74.43 111.168 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -117.73 60.67 0.77 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 60.15 110.825 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -163.11 148.7 11.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 75.14 110.923 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -130.6 141.54 50.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.119 -0.491 . . . . 74.1 111.122 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -139.8 -50.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.705 -0.76 . . . . 55.14 112.446 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 112.18 159.27 14.66 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 72.25 112.461 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 20.1 m -128.91 109.35 11.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.751 0.31 . . . . 74.41 111.139 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -96.0 123.98 39.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 71.13 111.111 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -115.05 111.29 20.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.213 -0.449 . . . . 75.55 110.921 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.81 113.97 25.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.109 -0.496 . . . . 75.12 111.138 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -130.28 143.09 50.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 60.34 110.924 179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 10.8 ttt180 -86.99 141.38 28.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 72.0 110.885 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -149.47 160.64 43.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 74.22 111.137 179.9 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -51.72 156.85 2.16 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.658 0.742 . . . . 75.33 110.894 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 -9.24 25.63 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.712 2.275 . . . . 74.31 112.375 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -77.87 -44.66 26.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 72.13 110.918 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 97.4 t -56.34 124.29 9.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 74.52 111.153 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -116.67 171.41 7.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 70.24 110.898 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 91.5 t -51.71 -49.52 34.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 72.43 111.101 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -53.02 -40.17 63.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 75.13 110.932 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 89.5 m -66.91 -45.43 77.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 71.54 111.182 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 8.7 mt -61.58 -51.08 70.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.205 -0.452 . . . . 63.23 110.923 179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -63.5 -37.0 85.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 71.34 110.863 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 29.5 mtt85 -63.75 -44.29 93.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 75.23 110.895 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -70.25 -36.62 74.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 75.4 110.895 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 38.4 mt -63.04 -53.05 59.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 75.33 110.92 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -67.97 -38.36 82.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 74.41 110.88 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -58.52 -48.56 80.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.3 110.914 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -65.89 -25.07 67.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 73.42 110.896 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.04 -17.88 19.38 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.754 -0.736 . . . . 55.25 112.464 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -62.18 160.21 32.96 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.65 0.738 . . . . 71.43 110.891 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 88.29 0.54 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.691 2.261 . . . . 72.22 112.337 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -104.64 -28.36 5.71 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.783 -0.722 . . . . 73.31 112.513 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt -64.91 -52.02 58.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.744 0.307 . . . . 74.3 110.949 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -75.76 -26.11 57.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 65.13 110.868 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -63.55 167.32 5.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 52.3 111.084 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.92 112.83 30.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 71.52 111.108 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 43.6 mt -97.67 129.35 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 74.22 111.106 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -123.01 142.67 50.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 71.41 111.088 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -98.64 129.43 45.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 72.12 110.915 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 84.7 t -122.88 102.69 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.257 -0.429 . . . . 74.23 111.151 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.17 109.13 10.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.45 . . . . 74.44 110.935 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -88.46 160.31 45.25 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.584 0.707 . . . . 74.3 111.081 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 74.48 1.29 Allowed 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.752 2.301 . . . . 75.13 112.315 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.6 t -176.54 137.02 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 64.31 111.154 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.68 28.64 2.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.435 . . . . 75.2 111.106 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.22 -34.74 3.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 64.02 111.088 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 13.8 m-85 -149.18 169.9 19.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 75.43 110.969 -179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 44.9 mtp180 -143.63 162.3 36.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 72.44 110.853 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -96.1 141.24 29.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 73.02 110.883 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -128.54 124.31 35.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 73.35 110.878 -179.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -99.53 110.01 22.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 72.15 110.943 179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.5 t -101.71 116.73 45.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.459 . . . . 75.53 111.107 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 26.1 tttt -96.5 108.25 20.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 71.02 110.881 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.5 mt -132.7 154.45 81.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.611 0.72 . . . . 75.53 110.903 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 162.09 43.43 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.726 2.284 . . . . 74.3 112.327 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 112.93 3.21 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.697 2.264 . . . . 71.21 112.302 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.5 mt -114.89 -172.68 2.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 75.1 110.921 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 31.6 m -64.32 149.34 48.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 62.24 110.88 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.94 -50.83 60.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.144 -0.48 . . . . 72.33 110.871 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -62.54 -37.19 85.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 74.23 110.853 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -64.49 -53.88 41.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.865 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -57.9 -51.11 70.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 74.52 110.82 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.7 -41.07 94.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.224 -0.444 . . . . 72.45 110.943 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -61.91 -47.36 85.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 72.42 110.884 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 29.6 tp -61.24 -51.1 70.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.188 -0.46 . . . . 74.55 110.961 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -55.52 -45.26 77.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 74.23 110.912 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 11.8 mtp85 -68.15 -38.68 82.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 74.44 110.902 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 4.9 tt -60.52 -41.94 95.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 74.35 110.93 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 9.8 m-85 -72.16 -50.64 26.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 73.22 110.832 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -61.47 -26.36 67.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 71.03 111.142 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 67.5 p -80.72 -62.67 1.6 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 74.15 110.908 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -65.98 -58.95 4.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.113 -0.494 . . . . 75.35 110.891 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.8 tp -68.92 -8.53 45.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.158 -0.473 . . . . 65.32 110.93 -179.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt 64.61 22.84 12.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 74.1 110.883 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.32 178.46 3.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 65.1 111.077 179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 63.3 m -145.03 110.91 5.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 72.21 111.111 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.2 t -52.15 123.63 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 74.15 111.156 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 18.4 mt -103.78 -49.64 3.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 74.43 110.942 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -151.26 172.67 15.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 63.44 111.082 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 89.3 p -163.35 155.23 17.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 63.55 110.886 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -141.13 140.78 34.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 73.51 110.913 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 14.0 m -143.05 145.74 33.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 74.21 111.092 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 42.4 t -109.79 114.05 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 75.24 111.114 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 C-N-CA 120.723 -0.751 . . . . 73.24 112.437 -180.0 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 16.1 mtm . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.828 0.347 . . . . 75.41 110.883 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 33.2 m -143.2 155.03 16.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.264 -0.425 . . . . 75.03 111.089 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 148.89 -127.57 2.55 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.727 -0.749 . . . . 73.14 112.498 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -168.76 167.16 11.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.85 0.357 . . . . 62.24 110.871 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -120.56 82.15 1.87 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 72.42 110.908 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -116.46 125.4 51.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 75.4 110.908 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 4.5 m 55.9 37.22 28.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 72.22 110.809 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 33.6 pt -60.5 -178.2 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 74.1 111.174 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -105.73 -21.43 13.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.244 -0.434 . . . . 73.41 110.884 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -105.53 78.67 1.38 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 72.13 110.95 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 2.8 m -103.0 157.0 17.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 74.44 111.123 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -142.64 -113.42 0.95 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.699 -0.762 . . . . 64.24 112.481 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -178.19 157.68 21.91 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.758 -0.734 . . . . 71.03 112.518 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 34.0 m -131.5 110.71 11.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.76 0.314 . . . . 75.02 111.117 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -96.59 119.73 35.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 72.54 111.147 179.808 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -110.43 113.77 26.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.995 0.426 . . . . 73.31 110.916 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.3 m -97.89 112.31 24.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.099 -0.501 . . . . 74.24 111.098 -179.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -134.19 142.39 47.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 73.24 110.917 179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -88.85 141.5 28.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 75.54 110.892 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -140.4 160.95 38.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 73.53 111.102 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -51.76 156.9 2.16 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.613 0.721 . . . . 74.11 110.89 -179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -9.14 25.37 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.686 2.257 . . . . 74.22 112.326 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -80.7 -43.08 20.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 73.22 110.82 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 72.1 t -65.69 134.19 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 75.01 111.116 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -125.81 175.88 7.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 71.43 110.903 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 60.6 t -51.65 -49.91 32.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 74.22 111.113 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -51.93 -41.46 62.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 72.44 110.899 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 88.4 m -67.91 -37.96 82.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.113 -0.494 . . . . 74.14 111.147 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 3.9 mt -64.94 -50.95 64.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 75.03 110.942 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 17.9 ptt85 -63.86 -42.94 97.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 72.12 110.855 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -61.66 -41.73 97.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.447 . . . . 75.2 110.862 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -69.46 -40.39 77.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 71.03 110.906 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.92 -51.77 67.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 72.54 110.936 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.87 -38.34 82.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 75.12 110.895 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -57.92 -48.84 78.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 61.21 110.901 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -67.67 -24.9 65.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 74.44 110.866 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -18.46 18.92 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.704 -0.76 . . . . 71.21 112.48 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.5 m-85 -65.35 160.27 59.96 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.705 0.765 . . . . 75.41 110.838 -179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 95.6 0.56 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.682 2.255 . . . . 74.42 112.334 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -112.3 -51.97 0.53 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.717 -0.754 . . . . 73.13 112.454 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -52.04 -51.56 56.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.713 0.292 . . . . 75.4 110.86 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -27.39 65.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 75.13 110.846 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -68.61 175.26 3.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 74.33 111.083 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.02 111.11 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.466 . . . . 71.32 111.151 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 69.5 mt -97.45 140.92 16.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 75.41 111.119 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.5 m -136.16 147.46 47.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 64.01 111.175 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -98.72 143.62 28.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.221 -0.445 . . . . 74.13 110.933 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 60.0 t -139.0 111.01 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.182 -0.463 . . . . 73.24 111.122 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.66 113.42 15.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 75.3 110.897 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -95.06 160.27 31.25 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.571 0.7 . . . . 73.54 111.099 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 74.56 1.27 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.707 2.271 . . . . 65.0 112.316 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.9 t -176.59 139.24 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 62.44 111.093 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.5 27.27 4.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 72.21 111.098 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.5 -34.94 3.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 54.4 111.12 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -146.03 162.63 37.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.241 -0.436 . . . . 75.24 110.945 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 71.3 mtt-85 -130.37 160.93 32.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.095 -0.502 . . . . 72.02 110.904 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 63.7 tt0 -94.23 139.76 30.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 63.12 110.905 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -127.85 124.64 38.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 74.52 110.905 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.09 103.58 14.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.164 -0.471 . . . . 64.31 110.966 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.5 t -96.82 127.94 48.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 73.23 111.142 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 41.6 tttt -106.91 109.0 20.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 75.55 110.871 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.5 mt -130.6 154.39 81.7 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.587 0.708 . . . . 74.55 110.921 179.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 162.14 43.2 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.654 2.236 . . . . 74.3 112.31 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 109.63 2.37 Favored 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.697 2.264 . . . . 74.52 112.31 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.7 mt -111.54 -172.35 2.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 75.5 110.943 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.66 153.67 42.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 74.15 110.827 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -52.1 -46.35 65.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 74.25 110.826 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -60.34 -36.0 76.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 74.22 110.877 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -66.36 -56.62 10.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 74.11 110.861 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 -54.93 -44.84 74.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.461 . . . . 74.14 110.878 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.3 mt -67.9 -41.04 83.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 74.05 110.92 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.17 -46.83 85.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.21 -0.45 . . . . 75.53 110.919 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 23.9 tp -64.95 -51.15 63.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 75.33 110.931 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -58.47 -50.25 74.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 75.22 110.902 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 96.8 mtt180 -58.45 -53.25 60.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 62.42 110.878 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 5.7 tt -52.76 -43.48 65.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.897 -179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -60.68 -56.47 20.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.456 . . . . 74.15 110.915 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.32 -13.34 60.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 75.3 111.121 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.65 -57.27 3.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 63.31 110.85 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -88.36 -52.29 5.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 71.42 110.831 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.77 -12.37 60.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 72.21 110.916 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp 57.25 23.53 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 74.45 110.924 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.36 174.21 2.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 73.52 111.079 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 92.4 m -135.49 110.96 9.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.215 -0.448 . . . . 73.5 111.114 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.7 t -58.22 108.34 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 72.51 111.133 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 10.3 mt -84.49 -49.2 8.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 74.54 110.963 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -159.03 173.8 15.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.468 . . . . 73.23 111.144 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 93.8 p -165.57 139.32 4.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 62.42 110.848 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -134.73 145.49 48.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 74.43 110.877 -179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 6.1 m -139.1 138.73 37.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.17 -0.468 . . . . 73.14 111.143 -179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 41.7 t -86.13 106.04 15.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.179 -0.464 . . . . 72.42 111.132 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.3 0 C-N-CA 120.723 -0.751 . . . . 61.12 112.491 179.982 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.8 0.333 . . . . 74.3 110.899 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 14.4 p -166.01 149.54 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.255 -0.429 . . . . 45.01 111.095 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -91.26 -104.77 1.36 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.745 -0.741 . . . . 73.13 112.504 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -144.7 116.12 8.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.869 0.366 . . . . 73.31 110.878 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -153.31 133.49 13.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 70.25 110.89 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 24.5 p90 -116.27 126.62 53.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 63.45 110.916 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 14.4 m -151.2 122.74 7.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 74.33 110.83 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 34.9 pt -113.14 148.2 16.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 74.33 111.134 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -159.95 113.19 2.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 75.23 110.894 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -108.94 -71.61 0.76 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 75.44 110.866 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 95.2 m -154.47 126.05 7.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 74.33 111.133 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 178.18 -94.18 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.772 -0.728 . . . . 65.2 112.465 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 106.63 150.35 17.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.72 -0.752 . . . . 71.25 112.487 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 2.7 m -125.29 107.51 10.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.743 0.306 . . . . 73.32 111.128 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.0 116.58 28.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 52.51 111.107 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -105.95 114.21 28.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 75.14 110.909 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -98.54 113.89 26.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 74.32 111.108 -179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -133.15 147.02 52.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 74.34 110.943 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.92 147.12 23.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 74.31 110.855 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -156.73 165.81 35.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 75.54 111.069 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -53.64 153.52 7.83 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.65 0.738 . . . . 64.33 110.9 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.7 -12.32 32.77 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.692 2.261 . . . . 74.43 112.326 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -74.24 -38.34 63.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 71.24 110.886 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 93.6 t -65.85 124.47 20.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 72.22 111.114 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -114.97 174.65 5.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 74.23 110.894 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 96.2 t -52.05 -45.77 41.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.173 -0.467 . . . . 75.42 111.151 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -54.42 -40.22 68.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 71.23 110.909 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 85.5 m -67.04 -44.17 80.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 73.12 111.179 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 5.1 mt -62.22 -51.04 69.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.435 . . . . 74.53 110.911 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 26.5 ptt180 -64.35 -35.95 82.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 75.34 110.869 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -63.92 -46.05 86.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 74.23 110.894 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -69.99 -36.11 74.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 75.22 110.925 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 35.7 mt -62.66 -52.78 61.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 74.23 110.912 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -68.62 -38.04 80.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 75.33 110.925 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -58.7 -48.02 82.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 72.15 110.878 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -67.38 -24.33 65.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 75.13 110.908 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.01 -18.86 18.6 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.738 -0.744 . . . . 74.35 112.513 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.1 m-85 -62.57 160.3 35.77 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.673 0.749 . . . . 72.32 110.896 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 93.18 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.747 2.298 . . . . 72.42 112.348 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -106.96 -41.03 1.74 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.733 -0.746 . . . . 73.52 112.513 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -58.75 -51.67 68.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.755 0.312 . . . . 75.54 110.94 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -31.19 67.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.439 . . . . 72.14 110.932 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -63.64 169.91 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 71.0 111.065 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.96 111.27 25.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 72.24 111.151 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 73.4 mt -96.87 136.35 27.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.2 -0.455 . . . . 74.31 111.131 179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.6 m -137.44 140.58 41.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 73.34 111.109 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -91.98 143.0 26.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.443 . . . . 73.53 110.885 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 99.0 t -133.74 125.65 49.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 73.12 111.143 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.97 126.29 30.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 54.24 110.951 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -109.53 160.2 28.69 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.564 0.697 . . . . 71.31 111.112 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 74.6 1.3 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.637 2.224 . . . . 72.45 112.35 -179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.9 t -179.91 137.11 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 64.54 111.123 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.6 24.49 5.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 74.4 111.114 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.03 -35.31 3.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 71.4 111.106 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -135.38 167.22 21.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 63.25 110.914 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 7.8 mmm-85 -137.26 162.2 34.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 71.41 110.886 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -95.47 144.84 25.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 74.12 110.909 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -131.52 122.29 25.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.45 110.898 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -103.11 103.57 13.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 75.24 110.899 -179.965 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.5 t -96.59 128.36 47.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 74.51 111.142 179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 38.4 tttm -104.65 108.55 20.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 74.11 110.873 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.9 mt -130.92 154.36 81.95 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.624 0.726 . . . . 70.13 110.924 179.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 162.09 43.41 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.697 2.265 . . . . 73.33 112.338 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.73 105.21 1.44 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.67 2.247 . . . . 75.52 112.321 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -105.04 -171.1 1.86 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 74.0 110.943 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 43.2 t -73.53 151.04 41.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 75.11 110.847 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -52.0 -50.02 62.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 70.42 110.912 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.3 -49.26 77.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.166 -0.47 . . . . 74.44 110.893 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 14.9 mmp_? -56.45 -56.78 16.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.162 -0.472 . . . . 72.54 110.902 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 26.1 mtp180 -53.35 -46.51 69.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 74.42 110.863 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.1 mt -61.44 -37.67 84.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.446 . . . . 74.14 110.945 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -66.3 -44.28 83.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.172 -0.467 . . . . 74.21 110.897 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.5 tp -63.04 -51.16 67.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 75.34 110.96 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -58.47 -49.55 76.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.457 . . . . 70.13 110.873 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 60.8 mtt-85 -58.48 -53.03 62.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 74.5 110.876 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 5.0 tt -52.71 -44.8 66.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 74.45 110.917 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -59.67 -56.39 22.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 73.23 110.871 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.3 -13.29 60.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 63.54 111.092 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 16.8 t -79.51 -57.26 3.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 75.22 110.849 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -88.37 -52.16 5.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 74.44 110.89 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.3 tp -67.83 -12.47 60.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 75.42 110.927 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 32.9 mmtm 57.62 23.11 8.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 75.54 110.87 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.18 -179.66 0.8 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 53.13 111.09 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 27.8 m -141.71 110.94 6.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 73.11 111.191 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.12 107.61 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 74.35 111.137 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 11.7 mt -83.28 -49.92 8.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 75.32 110.942 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.46 174.92 11.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 72.34 111.057 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 82.7 p -156.98 154.91 30.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 74.54 110.848 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -128.77 143.14 50.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.11 -0.496 . . . . 63.24 110.895 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 7.3 m -141.1 144.49 34.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 73.02 111.132 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 22.7 t -112.29 112.57 41.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 75.11 111.108 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 C-N-CA 120.768 -0.73 . . . . 73.44 112.494 179.953 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 57.1 mmm . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.827 0.346 . . . . 73.35 110.914 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 22.5 m -147.08 130.38 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 71.31 111.152 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -154.24 105.48 0.27 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.767 -0.73 . . . . 51.02 112.51 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -90.47 61.84 5.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.912 0.387 . . . . 71.12 110.891 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -170.09 134.99 1.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 74.44 110.906 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -141.89 120.21 12.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.176 -0.465 . . . . 72.04 110.941 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 25.6 p -130.31 169.12 15.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 74.44 110.888 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 66.7 mt -123.69 140.27 47.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 74.35 111.123 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -160.55 114.33 2.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 75.44 110.871 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -123.52 -55.37 1.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 74.24 110.846 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 14.8 t -128.37 171.91 11.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 74.52 111.184 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 109.46 117.36 3.95 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.731 -0.747 . . . . 74.42 112.532 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -129.92 149.15 18.73 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.739 -0.743 . . . . 73.23 112.455 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 16.0 m -126.77 109.01 11.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.811 0.339 . . . . 75.42 111.153 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.53 130.14 42.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 72.33 111.08 179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -119.34 113.6 21.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.203 -0.453 . . . . 75.31 110.953 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.78 110.98 23.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 65.33 111.126 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -132.51 143.51 49.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 72.14 110.957 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -91.05 142.82 27.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.878 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -144.58 170.9 15.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 71.24 111.103 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.28 160.54 40.06 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.607 0.718 . . . . 73.14 110.908 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 -14.53 36.25 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.683 2.255 . . . . 72.32 112.334 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -73.22 -44.99 58.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 73.12 110.849 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 98.5 t -64.06 138.45 23.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 75.43 111.13 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -136.27 178.98 6.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 71.43 110.882 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 48.5 t -51.74 -48.63 37.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 74.45 111.121 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 60.7 tt0 -51.7 -39.91 59.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 65.12 110.852 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.0 m -71.55 -35.42 70.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 72.51 111.195 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 4.9 mt -67.38 -44.71 78.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 73.25 110.888 179.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -69.97 -46.03 66.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 73.42 110.876 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.8 ptm180 -64.61 -32.7 74.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 54.35 110.895 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -73.8 -45.11 53.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 71.13 110.867 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 50.3 mt -62.58 -42.45 99.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 74.23 110.92 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.17 -37.79 66.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 73.35 110.896 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -61.45 -47.47 85.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 73.5 110.882 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -69.14 -24.29 64.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.164 -0.471 . . . . 75.3 110.913 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.05 -16.75 20.24 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.77 -0.729 . . . . 71.03 112.453 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -68.07 160.25 75.58 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.646 0.736 . . . . 74.41 110.834 -179.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 97.25 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.649 2.233 . . . . 61.44 112.363 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -109.83 -44.9 1.0 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.734 -0.746 . . . . 74.43 112.513 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -60.2 -52.0 67.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.757 0.313 . . . . 74.15 110.946 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -66.71 -33.4 75.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 74.55 110.907 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -63.78 175.4 1.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 71.01 111.096 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -127.04 116.35 44.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 74.34 111.137 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 64.1 mt -96.2 143.0 12.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 74.14 111.114 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.94 135.55 32.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.472 . . . . 74.43 111.167 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -94.89 143.98 26.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 72.31 110.888 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 82.7 t -138.62 106.16 3.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 74.33 111.17 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -72.79 101.38 3.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 73.52 110.907 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -79.96 160.23 69.22 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.589 0.709 . . . . 71.24 111.105 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.71 74.54 1.26 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.703 2.269 . . . . 74.23 112.377 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.9 t -176.38 139.56 0.35 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 71.22 111.162 -179.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -97.35 26.01 5.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 75.03 111.144 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.63 -35.06 3.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 74.42 111.143 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 16.6 m-85 -144.12 165.22 28.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.474 . . . . 74.03 110.915 -179.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 26.7 mtt-85 -134.57 156.98 47.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.085 -0.507 . . . . 74.42 110.844 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -89.47 135.54 33.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.885 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -123.62 123.54 40.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 62.22 110.892 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.61 107.95 19.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.171 -0.468 . . . . 74.02 110.928 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.57 121.59 51.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.449 . . . . 74.31 111.098 179.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 12.8 tttm -99.86 109.27 21.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 73.22 110.933 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.9 mt -131.24 154.26 81.91 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.596 0.712 . . . . 75.53 110.95 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 162.14 43.22 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.731 2.287 . . . . 73.31 112.329 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.86 109.62 2.38 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.622 2.215 . . . . 71.2 112.32 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.5 mt -111.32 -171.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 71.14 110.941 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 7.3 t -71.02 171.09 11.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 72.01 110.86 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -66.91 -48.18 69.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 74.03 110.873 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -59.07 -34.65 72.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 73.55 110.879 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 23.7 mmt180 -66.32 -55.76 14.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.455 . . . . 75.21 110.889 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -56.32 -43.27 78.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 75.14 110.868 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.3 mt -67.66 -39.35 84.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 75.52 110.938 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -66.31 -48.29 70.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 72.53 110.878 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.4 tp -62.02 -51.11 69.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 72.21 110.943 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -58.37 -51.22 70.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 73.15 110.883 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -57.96 -52.64 64.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 75.34 110.874 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 11.0 mt -52.85 -43.64 66.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 75.41 110.87 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -60.63 -56.52 20.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.438 . . . . 74.51 110.89 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.32 -13.29 60.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 70.32 111.09 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.61 -57.51 3.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.436 . . . . 74.34 110.812 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -88.38 -52.22 5.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 74.02 110.883 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.84 -12.42 60.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 74.02 110.883 -179.949 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.13 23.47 8.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 72.14 110.919 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.51 178.5 1.59 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 73.15 111.07 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 24.4 m -145.08 110.99 5.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 73.04 111.124 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 61.0 t -54.22 124.8 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 75.41 111.113 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 41.2 mt -108.2 -47.32 3.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 75.15 110.921 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -151.94 174.06 14.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 72.43 111.105 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 91.2 p -172.23 148.75 2.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.259 -0.428 . . . . 64.33 110.852 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -140.49 140.68 35.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.485 . . . . 74.14 110.855 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 8.0 m -137.49 143.91 41.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 73.52 111.115 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 80.5 t -91.61 110.79 23.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.176 -0.466 . . . . 74.44 111.123 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 C-N-CA 120.709 -0.757 . . . . 70.5 112.482 179.954 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 53.5 mtp . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.805 0.336 . . . . 73.25 110.827 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 34.7 m -127.77 173.52 12.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 73.31 111.118 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 174.95 110.23 0.25 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.727 -0.749 . . . . 62.21 112.471 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -157.85 141.55 15.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 75.31 110.895 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -161.41 142.7 11.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 73.24 110.848 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -116.8 133.96 55.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 64.42 110.891 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 2.9 m -119.48 127.53 53.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.086 -0.506 . . . . 73.44 110.862 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 19.9 pt -116.71 160.64 16.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.105 -0.498 . . . . 73.53 111.146 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -91.19 -21.5 21.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.451 . . . . 71.12 110.878 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -51.94 -35.61 46.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.11 110.868 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 1.5 m -69.07 146.32 52.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 74.14 111.1 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -103.61 -89.7 2.12 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.729 -0.748 . . . . 73.1 112.5 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -126.98 164.17 20.64 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.752 -0.737 . . . . 74.24 112.493 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 29.8 m -131.36 112.95 13.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.351 . . . . 73.21 111.135 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.02 127.68 41.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 73.33 111.121 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -116.4 109.84 17.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.451 . . . . 72.34 110.907 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -94.05 114.63 26.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 65.11 111.119 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -137.33 143.56 42.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 74.41 110.927 179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -95.86 143.15 27.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 74.22 110.865 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -145.77 171.03 15.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 74.42 111.1 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -61.28 160.66 21.95 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.673 0.749 . . . . 74.53 110.87 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -15.36 37.0 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.66 2.24 . . . . 71.11 112.357 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -69.73 -46.72 65.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 73.43 110.881 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 41.0 t -68.81 127.79 31.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 74.45 111.177 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -123.05 178.77 4.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.449 . . . . 74.15 110.931 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 59.1 t -51.65 -47.77 37.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 74.0 111.133 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -51.77 -40.18 59.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 54.21 110.923 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.1 m -71.12 -35.36 71.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 74.34 111.14 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 3.6 mt -67.3 -45.65 75.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 75.41 110.924 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -68.87 -46.13 69.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 74.43 110.865 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -64.86 -32.28 73.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 74.01 110.822 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -73.42 -44.6 57.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 73.24 110.92 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.74 -41.99 97.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.137 -0.483 . . . . 75.24 110.96 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -73.09 -37.71 66.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 73.13 110.949 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.32 -48.2 80.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.104 -0.498 . . . . 74.22 110.842 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -67.78 -24.44 65.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 73.51 110.858 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -15.93 20.75 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.756 -0.735 . . . . 72.3 112.505 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.6 m-85 -64.7 160.27 54.88 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.681 0.753 . . . . 73.32 110.853 -179.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 91.09 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.698 2.266 . . . . 72.34 112.359 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -106.93 -28.16 5.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.717 -0.754 . . . . 73.4 112.518 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -64.38 -51.85 61.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.778 0.323 . . . . 74.11 110.92 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -75.66 -34.38 60.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 74.5 110.883 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -52.85 165.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 75.03 111.1 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.04 110.95 24.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 74.34 111.112 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 61.1 mt -90.66 142.99 12.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 75.23 111.158 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.59 133.26 47.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 64.31 111.147 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 26.6 tp60 -97.35 118.54 34.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.14 110.936 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 98.1 t -123.32 97.69 4.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.251 -0.431 . . . . 62.31 111.184 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -74.87 99.06 3.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 75.44 110.908 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -66.98 160.32 70.83 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.567 0.699 . . . . 70.22 111.133 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 74.41 1.3 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.707 2.271 . . . . 73.42 112.354 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.9 t 179.1 140.21 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.231 -0.44 . . . . 74.24 111.097 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.41 33.24 1.62 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 71.11 111.111 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.63 -33.94 3.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 75.11 111.122 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -147.74 176.97 9.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 73.1 110.918 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -148.06 149.12 31.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 72.14 110.891 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -91.9 138.84 31.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 72.54 110.938 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -130.64 133.77 46.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 72.44 110.936 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -109.44 106.08 15.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 73.23 110.889 -179.935 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.02 112.27 27.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 73.43 111.139 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 35.3 tttp -90.47 112.11 23.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 75.24 110.913 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.5 mt -132.67 154.28 81.42 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.592 0.711 . . . . 72.11 110.895 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 162.2 42.99 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.67 2.247 . . . . 74.13 112.342 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 107.46 1.86 Allowed 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.665 2.244 . . . . 73.41 112.361 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -109.12 -170.99 1.76 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.195 -0.457 . . . . 74.03 110.958 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 7.8 p -72.74 152.05 41.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 74.52 110.89 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -51.94 -41.18 61.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.154 -0.475 . . . . 70.13 110.864 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -62.09 -43.93 97.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 65.33 110.858 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? -64.64 -48.48 74.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 74.32 110.903 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -56.41 -52.98 62.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 73.23 110.858 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -64.34 -40.51 96.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 74.34 110.925 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.46 -46.17 91.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 64.41 110.848 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 24.0 tp -64.01 -51.06 65.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 71.24 110.863 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -57.78 -50.12 74.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 72.54 110.871 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -57.94 -53.44 58.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 63.35 110.899 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 3.0 tt -52.63 -43.37 65.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 64.45 110.922 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -60.63 -56.53 20.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.21 110.894 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.43 -13.3 60.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 64.3 111.063 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.59 -57.3 3.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 73.03 110.882 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -88.36 -52.24 5.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.14 -0.482 . . . . 73.41 110.914 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.86 -12.42 60.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.54 110.933 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt 57.45 23.27 8.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.168 -0.469 . . . . 75.21 110.901 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.26 -179.05 0.92 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 75.12 111.075 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 89.8 m -145.01 110.95 5.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 73.42 111.171 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 31.7 t -55.62 108.53 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 75.43 111.149 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 27.2 mt -85.43 -43.19 13.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 73.52 110.925 179.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -166.54 174.54 8.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 74.33 111.059 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 75.7 m -161.38 148.93 15.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.454 . . . . 73.23 110.845 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 24.9 pt-20 -143.88 154.7 43.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 74.33 110.874 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 10.4 m -144.21 129.71 19.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 73.44 111.16 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 21.8 t -79.87 103.27 6.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.217 -0.447 . . . . 73.43 111.135 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.711 -0.757 . . . . 51.41 112.418 -179.975 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 17.9 ptp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.798 0.332 . . . . 74.5 110.91 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 27.8 m -110.77 138.26 39.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.255 -0.43 . . . . 75.45 111.135 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -68.03 -140.8 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.764 -0.732 . . . . 72.12 112.515 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -119.7 -56.98 2.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.879 0.371 . . . . 75.1 110.915 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -141.0 149.24 41.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 74.04 110.867 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -148.4 128.54 13.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 73.52 110.926 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 17.6 m -146.44 161.29 40.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 74.45 110.901 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 32.5 mm -104.38 136.67 36.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 72.04 111.119 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -113.14 -21.51 10.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 73.54 110.897 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 10.4 t80 62.95 35.95 12.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 72.51 110.868 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 34.4 m -72.3 137.41 46.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 75.31 111.117 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -69.33 -110.46 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.735 -0.745 . . . . 71.14 112.473 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -113.61 160.57 13.08 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.747 -0.739 . . . . 73.04 112.507 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 61.3 m -125.13 114.15 18.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 71.41 111.129 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -98.87 138.71 35.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 73.04 111.085 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -123.89 112.13 16.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 74.43 110.916 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.8 m -93.89 110.14 21.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 73.14 111.112 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -132.57 145.35 51.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 74.34 110.938 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 23.5 ttp180 -100.0 129.01 46.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 75.42 110.866 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -131.83 170.97 14.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 64.54 111.083 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -58.19 160.26 9.49 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.643 0.735 . . . . 62.33 110.86 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -15.66 37.17 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.724 2.282 . . . . 74.21 112.324 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -71.7 -45.56 61.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 74.11 110.93 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 99.2 t -61.42 121.11 8.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 72.42 111.123 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -117.07 173.79 6.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.913 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.5 t -51.56 -48.5 35.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 52.53 111.111 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -52.44 -39.81 61.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 75.52 110.896 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.3 m -71.2 -35.58 71.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 73.23 111.151 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 2.8 mt -67.36 -45.58 75.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 74.24 110.908 179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.6 ptt85 -69.0 -46.05 69.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 72.34 110.892 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -64.86 -32.12 73.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 74.41 110.82 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -73.36 -45.64 53.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.222 -0.445 . . . . 74.41 110.861 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 49.2 mt -62.86 -42.1 99.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 73.14 110.891 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -73.06 -37.65 66.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.431 . . . . 73.21 110.902 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -61.38 -48.92 79.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 73.53 110.955 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -67.51 -22.78 65.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.491 . . . . 71.22 110.907 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -18.43 18.95 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.739 -0.743 . . . . 74.11 112.474 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.4 m-85 -66.08 160.3 64.74 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.664 0.745 . . . . 74.12 110.876 -179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 101.93 0.97 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.71 2.273 . . . . 73.33 112.319 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -120.72 -30.55 1.36 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.731 -0.747 . . . . 75.33 112.472 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.2 -42.28 65.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.707 0.289 . . . . 74.01 110.882 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -80.46 -36.83 32.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 73.41 110.898 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -59.21 177.46 0.17 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.159 -0.473 . . . . 72.24 111.068 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.0 112.52 29.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 73.52 111.123 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 47.3 mt -96.16 128.06 47.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 71.41 111.12 179.938 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.98 147.21 46.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 74.02 111.122 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.5 tm0? -103.61 144.02 31.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 74.31 110.927 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 94.5 t -136.57 108.73 7.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 72.14 111.127 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.01 109.72 15.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 74.32 110.951 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -89.44 160.32 42.39 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.561 0.696 . . . . 71.1 111.139 179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 74.44 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.696 2.264 . . . . 75.33 112.35 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t 179.27 136.54 0.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 75.2 111.127 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -96.46 32.32 2.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 65.33 111.07 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.97 -34.16 3.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 73.35 111.092 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -150.81 145.67 25.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.208 -0.451 . . . . 74.34 110.944 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -115.98 154.39 29.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.117 -0.492 . . . . 74.43 110.87 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -92.18 149.23 21.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 72.13 110.893 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -138.96 133.51 31.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 74.43 110.907 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.15 106.8 16.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.131 -0.486 . . . . 71.21 110.937 -179.968 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 19.9 t -95.97 113.27 29.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 75.35 111.159 179.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 2.9 tptm -92.46 108.57 20.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.24 110.901 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.8 mt -132.45 154.55 81.6 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.608 0.718 . . . . 74.45 110.907 179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 162.29 42.62 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.719 2.28 . . . . 63.52 112.382 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 103.98 1.25 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.7 2.267 . . . . 72.05 112.334 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.4 mt -103.62 -171.05 1.87 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 75.2 110.917 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 28.4 t -70.22 149.06 47.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 73.02 110.815 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -51.71 -48.45 63.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 75.42 110.848 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.1 -44.82 96.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 72.43 110.927 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 21.7 mmt85 -59.07 -55.85 29.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 73.31 110.843 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 67.4 mtp180 -53.83 -53.0 58.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.881 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.1 mt -56.41 -37.01 69.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 75.03 110.903 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.0 -46.0 83.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 73.31 110.864 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 22.1 tp -61.44 -50.86 71.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 74.13 110.906 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -57.3 -50.91 71.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 75.03 110.902 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -58.04 -52.71 64.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.486 . . . . 74.33 110.85 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.4 tt -52.6 -44.19 65.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 73.11 110.913 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -60.43 -56.29 23.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 73.21 110.928 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.01 -13.43 59.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 71.44 111.142 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.9 t -79.66 -57.72 3.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 64.44 110.887 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -88.29 -52.18 5.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.118 -0.492 . . . . 73.3 110.91 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.82 -12.43 60.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 74.41 110.944 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 26.8 mmtp 56.74 24.0 8.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 74.41 110.867 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.77 177.72 1.98 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 73.43 111.076 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 40.8 m -140.28 110.87 6.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 71.04 111.136 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.51 102.03 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 74.51 111.137 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 28.6 mt -77.85 -43.25 30.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 75.4 110.917 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -168.55 176.44 5.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 65.23 111.109 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 99.2 p -160.18 153.94 22.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 60.54 110.864 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 8.2 pm0 -142.1 153.39 44.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 75.12 110.895 -179.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 47.3 m -144.29 131.68 20.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.464 . . . . 75.44 111.125 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 43.5 t -76.56 96.89 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 74.03 111.146 179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 C-N-CA 120.755 -0.736 . . . . 73.51 112.451 -179.989 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.83 0.348 . . . . 75.21 110.855 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 26.8 m -91.15 141.86 13.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.458 . . . . 61.41 111.137 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 129.34 42.87 0.22 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.747 -0.74 . . . . 64.24 112.504 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -124.08 73.15 1.21 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 63.4 110.858 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -94.43 -28.01 15.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.121 -0.491 . . . . 71.45 110.926 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -72.79 112.79 9.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.486 . . . . 74.35 110.908 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 32.6 p -162.91 126.25 2.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.119 -0.492 . . . . 73.32 110.881 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 47.2 mt -105.88 144.7 14.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 74.41 111.118 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -124.19 68.38 1.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 74.33 110.847 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -142.43 165.17 28.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 72.4 110.826 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 8.9 t -151.01 163.92 37.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 75.22 111.092 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 129.72 -58.42 0.71 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.726 -0.75 . . . . 72.13 112.495 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 111.42 150.27 11.67 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.767 -0.73 . . . . 54.53 112.465 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 25.7 m -128.52 113.4 15.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.825 0.345 . . . . 74.0 111.116 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.91 142.64 27.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 64.31 111.123 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -132.11 110.67 10.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.244 -0.435 . . . . 74.42 110.921 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.73 114.78 26.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 72.41 111.123 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -135.76 142.56 44.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 71.45 110.962 179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -88.3 146.94 25.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 74.13 110.865 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -152.54 169.73 21.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 74.3 111.131 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -70.49 160.66 80.61 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.669 0.747 . . . . 71.12 110.861 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -10.95 29.76 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.669 2.246 . . . . 74.32 112.301 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -71.29 -31.15 67.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 75.31 110.872 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 23.7 t -86.83 134.77 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.139 -0.482 . . . . 75.31 111.134 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -127.06 177.56 6.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.445 . . . . 74.44 110.9 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 81.8 t -51.96 -50.01 35.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 70.02 111.131 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -53.72 -40.07 65.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 73.55 110.923 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 63.7 m -67.52 -42.8 82.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 72.43 111.162 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 6.6 mt -61.21 -51.06 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 72.51 110.933 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -64.1 -40.12 95.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.85 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -60.46 -44.12 96.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.835 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -70.81 -39.55 73.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.441 . . . . 72.31 110.877 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 36.0 mt -58.87 -49.9 76.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 73.34 110.917 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -72.13 -37.98 69.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 74.31 110.886 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -56.06 -48.75 75.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 63.32 110.914 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 13.7 mmmt -69.71 -23.7 63.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.473 . . . . 73.21 110.948 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.0 -17.68 19.64 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.758 -0.734 . . . . 63.52 112.495 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -63.4 160.26 43.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.628 0.728 . . . . 71.11 110.881 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 93.39 0.52 Allowed 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.673 2.249 . . . . 71.13 112.348 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.16 -28.23 3.41 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.705 -0.76 . . . . 61.44 112.468 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -70.43 -51.74 27.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.718 0.294 . . . . 74.53 110.888 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.38 -34.34 67.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 75.03 110.932 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -61.46 172.32 1.2 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 75.22 111.107 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.97 116.47 44.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 64.31 111.101 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 65.5 mt -98.36 123.2 50.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 74.35 111.158 179.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.7 m -113.91 143.15 45.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 65.52 111.12 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -98.16 128.91 44.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 74.53 110.923 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.72 92.27 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 72.42 111.16 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.7 114.85 5.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 74.05 110.929 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -88.64 161.17 42.79 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.56 0.695 . . . . 75.33 111.128 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 72.17 1.47 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.762 2.308 . . . . 73.31 112.325 -179.967 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.4 t 177.23 141.9 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 74.12 111.15 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.87 31.35 2.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 52.32 111.138 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -126.06 -35.67 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 74.55 111.06 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -150.1 150.55 31.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.226 -0.443 . . . . 74.54 110.898 -179.876 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.18 161.76 34.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 73.13 110.859 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 41.1 tp10 -94.71 152.38 18.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 64.51 110.869 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -136.31 126.94 27.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 72.23 110.868 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -98.61 107.46 19.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 72.43 110.896 -179.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.4 t -95.88 112.02 27.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 75.41 111.114 179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -91.55 108.44 19.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.16 -0.473 . . . . 73.11 110.903 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.3 mt -131.86 154.47 81.77 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.605 0.717 . . . . 74.34 110.893 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 162.22 42.94 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.675 2.25 . . . . 63.44 112.352 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 106.45 1.67 Allowed 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.733 2.289 . . . . 70.42 112.317 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -108.83 -171.02 1.77 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 74.34 110.941 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 53.7 m -71.79 153.83 41.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 74.55 110.848 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -52.27 -47.44 65.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.128 -0.487 . . . . 63.41 110.844 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -58.95 -37.77 77.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 74.41 110.926 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.4 mmp_? -64.22 -58.04 7.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 73.35 110.839 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -53.1 -47.02 68.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 73.21 110.873 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mt -66.01 -37.04 84.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 73.04 110.882 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -65.97 -46.66 77.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.831 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -63.99 -51.18 65.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 73.23 110.921 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -58.14 -50.45 73.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 72.12 110.854 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -58.05 -53.41 58.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 72.02 110.878 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.9 mt -52.63 -43.59 65.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 71.32 110.941 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.53 -56.56 19.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 75.41 110.857 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.26 -13.32 60.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 75.13 111.1 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 22.8 t -79.6 -57.39 3.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 75.22 110.845 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -88.4 -52.18 5.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 74.22 110.879 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -12.36 60.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 71.55 110.91 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.5 mmmt 57.11 23.58 8.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 71.35 110.894 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.95 177.86 1.57 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.44 111.077 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 49.1 m -140.39 111.01 6.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 75.13 111.12 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 61.8 t -60.47 119.56 4.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 73.34 111.108 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 17.6 mt -103.09 -48.03 4.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 55.12 110.89 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -143.61 170.09 16.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 74.02 111.073 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 54.8 p -175.8 133.99 0.28 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 64.14 110.851 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -128.28 140.54 51.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 73.05 110.877 -179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 3.3 m -133.14 146.54 51.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 75.32 111.168 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 40.0 t -114.73 111.97 38.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 72.43 111.153 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 C-N-CA 120.768 -0.73 . . . . 73.54 112.511 179.991 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 3.6 ptp . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.838 0.351 . . . . 73.03 110.866 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 9.3 p -165.93 141.1 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 72.03 111.168 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -162.87 89.41 0.11 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.792 -0.718 . . . . 65.13 112.474 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -147.26 134.08 20.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.85 0.357 . . . . 74.32 110.864 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -164.72 137.49 4.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 71.24 110.911 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 10.9 p90 -134.48 149.67 50.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 73.01 110.915 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 87.9 p -129.08 179.17 5.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 54.01 110.869 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 2.7 pp -147.28 -177.16 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 74.4 111.119 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -163.93 112.13 1.17 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.191 -0.458 . . . . 75.32 110.893 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -153.88 137.82 16.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.435 . . . . 74.12 110.888 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 11.9 m -125.92 125.67 43.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 63.52 111.123 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 161.14 -69.01 0.24 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.749 -0.738 . . . . 64.52 112.511 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 133.24 149.52 6.14 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.72 -0.752 . . . . 71.2 112.477 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 97.0 m -129.95 106.89 8.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.783 0.325 . . . . 74.21 111.126 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.97 136.42 35.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 72.21 111.121 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -124.2 111.18 15.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.252 -0.431 . . . . 74.04 110.906 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -94.92 110.97 22.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 73.2 111.172 -180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -135.73 146.38 47.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.246 -0.434 . . . . 64.04 110.937 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 26.1 mtp180 -97.4 127.22 43.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.16 -0.473 . . . . 74.13 110.868 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -123.84 171.06 9.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 72.44 111.134 179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -66.29 160.63 63.88 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.667 0.746 . . . . 72.25 110.901 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -16.3 37.63 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.692 2.261 . . . . 73.22 112.366 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -72.5 -34.02 67.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 65.33 110.887 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 85.4 t -80.14 124.59 38.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.475 . . . . 74.35 111.132 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -118.61 178.85 4.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 74.54 110.878 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 38.7 t -51.62 -48.73 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 75.24 111.158 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -51.71 -41.12 61.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 70.31 110.882 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.4 m -71.09 -34.55 71.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 62.41 111.14 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 2.3 mt -67.48 -44.54 78.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.451 . . . . 74.34 110.872 179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -70.08 -45.55 66.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 74.11 110.849 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -65.05 -32.62 74.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 72.54 110.84 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -73.58 -46.3 48.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 74.02 110.884 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.7 -42.3 98.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 74.45 110.893 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.24 -37.55 66.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 74.13 110.907 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -60.58 -49.31 78.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 75.13 110.897 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -24.02 67.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 74.2 110.918 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.07 -17.73 19.43 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.794 -0.717 . . . . 75.32 112.518 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 15.3 m-85 -68.01 160.3 75.05 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.666 0.746 . . . . 71.03 110.852 -179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 100.25 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.693 2.262 . . . . 75.03 112.29 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -119.85 -25.19 2.62 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.757 -0.735 . . . . 61.54 112.458 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -72.88 -40.18 65.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.735 0.302 . . . . 71.22 110.914 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -85.23 -34.29 22.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 75.2 110.873 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -61.43 -177.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.445 . . . . 65.54 111.087 179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 23.4 t -126.98 143.06 41.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 72.34 111.108 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 30.6 mt -125.61 120.4 57.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.174 -0.466 . . . . 60.15 111.129 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.53 141.6 48.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 74.3 111.163 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -100.37 141.65 32.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 73.14 110.91 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 93.2 t -135.0 108.55 10.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 71.53 111.164 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 12.4 tm0? -71.19 116.74 11.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.947 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -96.22 160.23 30.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.575 0.702 . . . . 61.14 111.129 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 74.6 1.28 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.663 2.242 . . . . 71.33 112.306 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.3 t 179.99 138.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 75.04 111.1 179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.48 27.18 3.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 73.3 111.09 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.53 -34.93 3.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 75.12 111.081 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -144.98 164.75 30.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 73.42 110.943 -179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 48.9 mtm180 -137.33 160.61 38.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 72.42 110.898 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -93.98 149.31 21.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 72.02 110.886 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 83.1 m-85 -142.43 134.57 27.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 72.23 110.848 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -108.36 107.72 18.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.095 -0.502 . . . . 73.31 110.91 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.3 t -96.2 112.46 28.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 74.31 111.1 179.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 34.7 tttt -91.93 108.93 20.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.479 . . . . 73.33 110.901 179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.3 mt -131.89 154.42 81.74 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.631 0.729 . . . . 64.41 110.89 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 162.25 42.79 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.627 2.218 . . . . 74.32 112.341 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 112.42 3.08 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.678 2.252 . . . . 64.33 112.308 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.79 -170.98 1.77 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 73.32 110.91 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 40.9 t -68.88 155.51 40.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 55.34 110.844 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -54.73 -50.31 68.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 75.33 110.905 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -60.06 -37.16 79.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.458 . . . . 75.33 110.881 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -64.19 -55.6 20.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 75.4 110.893 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 53.7 mtm180 -55.81 -53.06 61.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 73.54 110.844 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.0 mt -59.23 -37.77 78.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 71.12 110.897 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.93 -50.07 67.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 75.14 110.877 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 23.0 tp -57.92 -51.08 71.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 61.42 110.922 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -57.26 -50.89 71.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.454 . . . . 74.21 110.869 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -57.88 -51.91 67.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 75.41 110.878 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.8 -44.65 66.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 74.03 110.851 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -60.39 -56.35 22.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 74.03 110.878 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.87 -13.47 59.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 73.34 111.102 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.61 -57.96 3.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 75.21 110.859 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -88.26 -52.2 5.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.489 . . . . 75.35 110.907 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.76 -12.47 60.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 73.54 110.871 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt 56.3 24.37 8.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 75.35 110.905 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.41 174.14 3.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 73.22 111.091 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 93.3 m -133.72 111.69 10.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 75.45 111.13 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.98 109.04 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 50.41 111.15 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 11.7 mt -86.84 -45.38 10.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 75.41 110.922 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.61 172.38 14.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 70.13 111.144 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 20.6 p -158.26 157.37 32.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 73.24 110.877 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -136.45 139.63 42.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 75.43 110.892 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 87.1 m -142.07 144.79 33.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.135 -0.484 . . . . 73.12 111.16 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 51.5 t -98.52 111.94 29.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 75.21 111.114 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 C-N-CA 120.759 -0.734 . . . . 75.24 112.517 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.782 0.325 . . . . 75.31 110.893 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 9.9 m -141.35 177.81 3.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.249 -0.432 . . . . 64.45 111.138 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -177.81 -155.72 14.74 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.742 -0.742 . . . . 72.35 112.489 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -102.93 154.92 18.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.903 0.382 . . . . 75.13 110.849 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -61.28 -73.12 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 72.34 110.896 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 43.8 p90 -162.09 -179.17 6.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 75.33 110.947 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 6.7 m -156.73 161.12 39.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 74.42 110.9 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 38.2 pt -100.64 146.97 8.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 73.53 111.141 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -149.29 111.71 4.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 73.12 110.835 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -120.22 40.73 3.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 70.21 110.885 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -81.01 158.96 24.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 71.23 111.142 -179.928 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -103.89 -83.44 1.7 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.778 -0.725 . . . . 53.22 112.466 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -129.31 155.45 20.8 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.745 -0.741 . . . . 63.3 112.51 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 25.0 m -127.25 108.65 11.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.835 0.35 . . . . 73.22 111.147 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.41 129.99 42.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 74.45 111.151 179.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -118.24 113.32 21.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.244 -0.434 . . . . 74.42 110.936 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -94.38 110.33 22.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 72.54 111.115 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -130.51 143.6 50.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 75.55 110.933 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -94.1 126.77 39.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 74.51 110.894 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -127.02 170.95 11.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 74.42 111.141 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -61.21 160.42 22.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.666 0.746 . . . . 75.14 110.881 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -17.76 37.36 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.698 2.265 . . . . 75.14 112.303 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -73.02 -44.15 61.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 73.0 110.944 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 95.7 t -60.71 125.55 17.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 73.14 111.143 179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -123.48 176.68 6.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 71.42 110.862 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 90.3 t -51.63 -49.24 35.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.487 . . . . 73.5 111.096 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -51.17 -40.27 58.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 73.52 110.911 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.3 m -72.96 -35.12 66.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 73.24 111.154 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 4.8 mt -67.46 -44.1 79.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 74.55 110.908 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.05 -46.13 62.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 73.21 110.888 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -63.97 -33.21 75.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 74.43 110.907 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -73.98 -47.44 37.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.465 . . . . 73.5 110.835 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 35.8 mt -59.6 -43.35 93.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 74.35 110.91 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -73.09 -37.76 66.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.169 -0.469 . . . . 73.02 110.92 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.35 -49.04 78.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 74.01 110.871 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -68.2 -24.76 64.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 74.34 110.901 179.959 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -17.98 19.34 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.754 -0.736 . . . . 73.04 112.475 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -61.54 160.28 26.81 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.66 0.743 . . . . 71.44 110.846 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 86.87 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.672 2.248 . . . . 74.43 112.32 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -108.89 -22.09 7.12 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.745 -0.74 . . . . 74.23 112.494 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -75.85 -40.79 54.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.727 0.299 . . . . 75.4 110.839 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -85.28 -29.45 24.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.427 . . . . 74.2 110.887 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -62.77 173.8 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.466 . . . . 64.42 111.078 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.05 117.04 46.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.42 111.152 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 62.1 mt -96.91 137.33 24.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 75.3 111.071 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.13 150.35 52.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 73.45 111.146 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -102.5 144.0 31.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.913 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.5 t -138.62 108.95 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 72.43 111.136 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -77.56 107.42 10.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 73.14 110.929 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -88.9 160.22 44.13 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.578 0.704 . . . . 74.13 111.103 179.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 74.54 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.68 2.254 . . . . 72.33 112.353 179.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t -176.03 140.05 0.4 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 75.14 111.136 -179.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -99.95 26.31 6.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 65.3 111.096 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.69 -34.02 3.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 73.52 111.1 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 12.0 m-85 -145.1 157.28 44.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 74.41 110.925 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.16 157.43 34.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 74.31 110.873 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 12.4 mt-10 -93.73 141.86 28.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 74.23 110.901 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -130.46 128.95 42.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 72.12 110.846 -179.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -104.15 105.51 15.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 75.25 110.957 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.2 t -95.98 116.68 38.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 73.54 111.148 179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 5.7 tptm -94.74 107.41 19.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 73.53 110.896 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.4 mt -130.65 154.29 81.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.56 0.695 . . . . 70.31 110.939 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 162.14 43.25 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.646 2.231 . . . . 61.21 112.341 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 108.83 2.17 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.682 2.254 . . . . 74.33 112.338 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.2 mt -109.41 -171.08 1.77 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 71.3 110.93 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.84 154.88 40.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 72.14 110.82 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -51.98 -46.08 64.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.096 -0.502 . . . . 71.21 110.875 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.85 -36.12 78.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 71.34 110.877 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -65.04 -54.35 31.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 72.24 110.888 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 43.0 mtt180 -57.16 -48.11 79.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 72.32 110.865 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.7 mt -63.8 -43.59 95.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 75.14 110.888 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -62.92 -44.51 95.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 73.34 110.892 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.2 tp -62.35 -51.23 68.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.157 -0.474 . . . . 53.05 110.938 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -56.08 -49.66 73.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 75.04 110.919 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -57.93 -51.91 67.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 72.43 110.857 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -52.88 -44.35 66.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 63.12 110.9 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -60.31 -56.74 17.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 72.03 110.84 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.18 -13.11 59.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 70.34 111.122 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.73 -58.31 3.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 60.44 110.816 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -88.56 -52.17 5.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 75.14 110.828 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.8 tp -67.76 -12.71 61.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 75.23 110.919 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp 56.65 23.36 7.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.22 110.904 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -71.2 -179.82 2.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 74.02 111.125 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 94.2 m -144.99 111.29 5.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 73.54 111.144 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.4 t -53.23 122.81 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 75.31 111.158 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 18.2 mt -101.28 -47.55 4.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 73.31 110.893 179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -158.28 175.15 14.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 64.52 111.092 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 88.5 p -161.33 152.71 18.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.443 . . . . 75.24 110.867 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -134.36 149.49 50.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 74.44 110.845 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 51.5 m -144.07 136.1 26.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.121 -0.49 . . . . 71.52 111.089 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 24.2 t -94.14 101.04 12.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 74.03 111.136 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.719 -0.753 . . . . 74.34 112.529 -179.995 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 27.5 mtt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.786 0.327 . . . . 75.33 110.895 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 60.1 t -112.08 118.93 58.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.287 -0.415 . . . . 74.41 111.149 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -144.17 93.33 0.17 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.698 -0.763 . . . . 74.41 112.527 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -109.98 -68.8 0.9 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.824 0.345 . . . . 71.52 110.894 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -111.97 105.35 13.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 71.2 110.868 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -58.24 120.19 8.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 75.12 110.914 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 2.4 m -119.85 153.54 35.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 73.44 110.873 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 22.4 pt -108.75 174.53 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 74.44 111.144 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.11 -21.32 39.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 61.54 110.862 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -74.16 99.34 3.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 71.55 110.881 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 9.8 t -141.65 153.28 44.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 74.22 111.139 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 140.76 -68.33 0.48 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.693 -0.765 . . . . 44.35 112.435 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 166.23 149.88 6.11 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.742 -0.742 . . . . 74.1 112.481 -179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 95.6 m -130.04 112.59 13.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.792 0.33 . . . . 62.44 111.135 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.95 143.89 26.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 64.43 111.085 179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -131.44 116.41 17.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 74.0 110.916 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.1 112.48 24.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.124 -0.489 . . . . 55.31 111.13 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -134.78 147.8 50.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.967 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 6.8 ttt180 -93.17 136.23 33.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.455 . . . . 75.43 110.883 179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -139.67 161.86 36.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 71.34 111.105 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.2 pm0 -51.98 156.87 2.35 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.685 0.755 . . . . 73.44 110.879 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -8.82 24.57 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.65 2.234 . . . . 73.22 112.339 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -82.43 -42.4 18.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 75.35 110.881 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 97.7 t -64.16 124.09 18.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 75.12 111.14 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -120.55 177.42 5.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.203 -0.453 . . . . 75.4 110.865 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 47.7 t -51.46 -47.49 35.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 74.1 111.113 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -51.83 -41.65 61.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.23 110.852 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.9 m -70.79 -34.46 71.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 72.42 111.123 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 2.6 mt -67.2 -45.42 76.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 73.24 110.9 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 -69.89 -45.42 67.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 72.25 110.83 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -64.93 -31.94 73.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 72.05 110.9 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -75.17 -43.24 53.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 73.52 110.868 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 51.0 mt -63.48 -43.96 95.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.465 . . . . 75.53 110.885 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -71.71 -42.07 67.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 71.21 110.9 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.89 -49.0 78.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 71.24 110.868 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -66.24 -23.98 66.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.462 . . . . 74.01 110.896 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -18.67 18.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.706 -0.759 . . . . 74.54 112.472 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -67.52 160.25 73.42 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.682 0.753 . . . . 73.25 110.851 -179.815 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 101.7 0.94 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.671 2.247 . . . . 74.2 112.335 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -123.51 -33.06 0.84 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.719 -0.753 . . . . 41.41 112.496 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 20.5 pttt -61.52 -43.5 98.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.746 0.308 . . . . 73.55 110.911 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -83.38 -31.51 26.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 74.23 110.883 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -55.79 172.06 0.19 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 75.51 111.114 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.6 t -126.93 111.09 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 72.14 111.109 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 34.5 mt -92.28 142.45 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 75.42 111.147 179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.53 134.83 36.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 74.35 111.157 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -91.52 142.76 27.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 71.52 110.883 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 61.7 t -138.15 108.27 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 70.04 111.168 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -74.9 132.68 41.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 75.35 110.919 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -116.1 160.3 36.11 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.593 0.711 . . . . 45.12 111.099 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 74.45 1.3 Allowed 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.65 2.234 . . . . 64.21 112.358 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 3.0 t -179.83 141.77 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.254 -0.43 . . . . 64.14 111.16 -179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -101.04 29.02 4.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 74.3 111.142 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.6 -34.66 3.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 71.23 111.084 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -146.38 166.09 27.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.442 . . . . 73.14 110.929 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 19.8 mtm-85 -136.83 160.92 37.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 72.41 110.873 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -93.94 140.21 29.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 75.11 110.903 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -130.8 132.42 45.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.115 -0.493 . . . . 73.44 110.907 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.99 107.05 15.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 73.23 110.904 -179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.1 t -97.35 133.5 38.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 74.51 111.098 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 43.6 tttt -108.65 107.94 18.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 73.24 110.93 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.8 mt -129.7 154.61 80.98 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.628 0.728 . . . . 75.34 110.89 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.28 42.67 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.716 2.278 . . . . 72.3 112.306 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 110.95 2.67 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.679 2.252 . . . . 71.34 112.361 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.6 mt -114.28 -170.99 1.83 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.429 . . . . 74.43 110.915 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.1 p -74.55 154.03 38.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 73.45 110.862 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -51.92 -40.62 61.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 74.34 110.839 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -61.25 -42.88 99.38 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.455 . . . . 73.43 110.926 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -63.34 -52.58 61.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 75.23 110.903 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -54.5 -52.95 60.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 71.41 110.845 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.36 -36.18 82.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 70.41 110.913 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -64.54 -49.84 69.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 72.01 110.903 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -62.53 -51.0 69.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 75.44 110.975 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -56.37 -47.71 78.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 72.53 110.891 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -59.87 -53.89 52.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 74.41 110.848 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -52.66 -44.08 65.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 72.23 110.898 -179.964 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.26 -56.46 21.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 75.54 110.887 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.14 -13.37 60.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 75.4 111.16 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 20.0 t -79.57 -57.54 3.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 71.42 110.829 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -88.38 -52.26 5.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 75.14 110.899 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.76 -12.46 60.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.111 -0.495 . . . . 73.22 110.952 179.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 23.1 mmtp 57.16 23.46 8.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 65.52 110.893 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.32 178.39 1.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.454 . . . . 74.33 111.094 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 90.8 m -145.01 110.91 5.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 75.21 111.154 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 36.4 t -54.73 131.88 17.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 74.25 111.117 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 46.5 mt -115.18 -43.6 3.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 74.52 110.888 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -157.44 174.85 14.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 64.24 111.087 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 5.2 p -169.27 148.63 3.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 74.43 110.813 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -133.09 148.53 52.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.113 -0.494 . . . . 75.45 110.927 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 3.9 m -138.97 145.48 39.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 72.53 111.149 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 68.0 t -100.33 103.76 15.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.228 -0.442 . . . . 71.11 111.162 179.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.749 -0.739 . . . . 74.45 112.503 -179.99 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 17.7 ptt? . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.797 0.332 . . . . 74.33 110.921 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 16.7 m -133.99 169.57 21.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.433 . . . . 75.34 111.146 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 91.41 59.94 1.33 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.708 -0.758 . . . . 63.22 112.476 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -140.15 161.32 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.856 0.36 . . . . 73.12 110.864 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -171.36 126.13 0.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.31 110.884 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -133.76 147.19 51.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 75.24 110.947 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 2.9 p -132.19 142.3 49.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.107 -0.497 . . . . 72.12 110.862 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 26.7 mm -94.48 141.82 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 72.3 111.159 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.41 23.16 14.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 75.31 110.837 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 7.1 t80 52.96 46.84 25.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 74.43 110.882 -179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 8.9 t -80.95 163.56 23.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 73.11 111.173 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -69.31 -54.54 12.91 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.72 -0.753 . . . . 54.34 112.475 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 137.91 179.2 16.78 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.756 -0.735 . . . . 64.41 112.544 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 33.2 m -125.19 108.35 11.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.788 0.328 . . . . 73.31 111.116 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -96.75 125.22 41.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 74.21 111.073 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -114.82 112.36 22.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 73.11 110.929 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -95.41 112.92 24.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 72.45 111.166 179.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -134.01 143.2 47.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.246 -0.434 . . . . 64.25 110.924 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -89.27 142.58 27.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 75.23 110.842 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -141.66 166.65 24.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.156 -0.475 . . . . 72.33 111.148 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -55.88 160.55 4.27 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.674 0.749 . . . . 73.35 110.876 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -17.67 37.19 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.632 2.222 . . . . 72.14 112.358 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -76.13 -40.45 52.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 71.34 110.955 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 82.7 t -59.22 137.33 21.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 72.53 111.091 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -133.65 175.65 9.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 70.22 110.904 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 85.1 t -51.92 -47.76 40.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.463 . . . . 64.32 111.146 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -54.12 -39.67 66.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 65.54 110.901 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 85.5 m -67.01 -43.13 83.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 74.31 111.143 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 6.4 mt -62.63 -51.08 68.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.45 . . . . 75.41 110.927 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -64.42 -36.28 83.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 74.12 110.897 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -63.95 -45.71 87.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 71.34 110.869 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -70.08 -36.13 74.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 74.42 110.856 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 43.4 mt -62.89 -52.93 61.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.166 -0.47 . . . . 75.21 110.947 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -68.71 -38.01 79.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.471 . . . . 75.32 110.852 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.88 -47.51 84.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.55 110.934 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -67.82 -25.08 65.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 74.54 110.908 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 113.96 -18.28 19.23 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.754 -0.736 . . . . 71.01 112.505 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -62.96 160.28 39.4 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.655 0.74 . . . . 72.44 110.867 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 91.31 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 65.42 112.303 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -108.76 -30.17 3.84 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.733 -0.746 . . . . 70.42 112.518 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -62.73 -51.96 65.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.768 0.318 . . . . 71.1 110.908 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -75.37 -29.89 60.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 72.24 110.918 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -57.43 168.66 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 75.35 111.119 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.01 111.13 24.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 73.12 111.109 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 53.8 mt -99.47 134.66 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.474 . . . . 74.14 111.14 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 4.0 m -134.68 155.24 50.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.182 -0.463 . . . . 75.02 111.105 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -102.85 143.99 31.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 74.03 110.922 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.0 t -136.96 127.01 39.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 75.14 111.115 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -80.98 99.13 8.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 74.14 110.899 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -79.62 160.26 70.05 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.573 0.701 . . . . 62.32 111.081 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 74.47 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.681 2.254 . . . . 73.41 112.365 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t -177.32 139.23 0.25 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 73.42 111.151 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.0 24.98 6.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 61.22 111.105 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.19 -35.49 2.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 72.42 111.082 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -136.83 161.41 36.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 72.51 110.891 -179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -123.75 155.56 37.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 75.21 110.895 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -90.55 144.46 25.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 72.2 110.887 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -130.2 124.55 32.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 74.4 110.866 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.14 105.09 16.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.114 -0.494 . . . . 73.51 110.926 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.6 t -96.02 123.81 48.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 72.32 111.096 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 18.2 tttp -102.68 108.56 19.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 75.23 110.904 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.4 mt -132.06 154.45 81.69 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.622 0.725 . . . . 74.52 110.89 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 162.14 43.2 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.682 2.254 . . . . 64.43 112.333 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 107.28 1.83 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.676 2.251 . . . . 73.25 112.362 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 5.1 mt -109.85 -171.03 1.76 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.235 -0.439 . . . . 72.1 110.928 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.01 153.69 41.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 74.24 110.871 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -52.09 -45.86 65.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.146 -0.479 . . . . 74.03 110.867 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -60.05 -37.46 79.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.176 -0.466 . . . . 73.31 110.903 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -65.65 -57.47 8.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 72.32 110.849 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -53.25 -46.43 69.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 74.32 110.892 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -67.02 -38.8 86.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 74.23 110.96 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -64.08 -46.4 84.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 75.35 110.887 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.12 -51.06 63.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.48 . . . . 75.54 110.911 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -58.34 -49.05 78.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 73.2 110.896 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -58.76 -53.73 55.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 75.04 110.872 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.1 mt -52.75 -43.66 65.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 61.52 110.894 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.31 -56.39 22.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 70.45 110.898 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.58 -13.23 60.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 61.41 111.091 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.6 t -79.55 -56.84 4.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 64.02 110.873 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -88.37 -52.16 5.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 73.41 110.91 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -67.96 -12.17 60.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 75.3 110.905 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt 57.57 23.46 9.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 73.34 110.877 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -64.58 -179.55 0.5 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 70.43 111.1 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 90.5 m -144.71 110.88 5.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 72.51 111.188 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.8 t -57.04 118.87 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 74.01 111.172 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 55.8 mt -99.75 -47.7 4.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 73.42 110.874 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.53 173.45 16.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 71.51 111.106 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 6.1 p -165.49 149.95 8.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 74.25 110.85 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -137.65 144.8 42.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.1 -0.5 . . . . 73.1 110.904 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 44.4 m -143.54 147.14 34.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 74.32 111.142 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 21.9 t -115.09 123.16 70.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.43 . . . . 72.33 111.074 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 73.31 112.503 179.991 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.86 0.362 . . . . 74.25 110.87 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 12.3 m -53.96 156.78 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 74.33 111.145 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 167.13 -99.86 0.16 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.739 -0.744 . . . . 51.43 112.488 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -78.89 136.4 37.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 75.3 110.916 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -95.32 121.7 37.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 54.44 110.906 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 41.9 p90 -140.76 154.32 46.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 74.22 110.928 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 22.1 t -167.63 172.71 9.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 65.22 110.874 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 2.7 pp -126.83 161.83 32.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 75.52 111.131 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.32 -21.77 13.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 42.31 110.909 179.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.0 t80 62.0 28.43 17.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 73.23 110.847 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 11.8 t -98.53 30.32 3.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 65.14 111.108 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 175.43 -100.62 0.15 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.751 -0.737 . . . . 61.22 112.513 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 137.55 171.38 12.17 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.704 -0.76 . . . . 72.14 112.482 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 7.1 m -122.84 107.54 11.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.776 0.322 . . . . 71.12 111.141 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.3 130.09 42.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 72.01 111.128 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -120.32 110.53 16.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 75.01 110.902 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.8 m -94.26 111.35 23.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 74.34 111.18 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -130.31 143.16 50.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 70.33 110.962 179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 12.1 ttt180 -89.67 148.02 23.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 75.33 110.828 -179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -153.35 169.64 22.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 74.24 111.102 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -62.6 160.54 34.06 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.646 0.736 . . . . 63.34 110.9 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -17.6 37.37 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.67 2.247 . . . . 65.34 112.358 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 38.8 m-20 -69.18 -45.73 69.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 72.43 110.913 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 42.7 t -65.22 129.56 29.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 75.35 111.127 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -124.16 177.29 5.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.21 110.886 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.8 t -51.7 -48.07 37.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 71.31 111.137 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -52.02 -41.05 61.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.899 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 95.4 m -68.95 -39.55 79.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.35 111.145 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 10.2 mt -64.03 -51.08 65.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 71.33 110.916 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -65.09 -40.95 95.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 75.43 110.85 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -61.34 -43.27 99.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 64.42 110.828 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -70.51 -37.75 74.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 73.32 110.932 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 33.9 mt -61.33 -51.82 67.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 74.12 110.89 -179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -69.62 -37.98 77.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 75.42 110.879 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -57.39 -48.96 77.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.485 . . . . 73.12 110.897 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 17.2 mmtp -67.36 -24.05 65.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.191 -0.459 . . . . 73.13 110.89 179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.1 -18.3 18.85 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.725 -0.75 . . . . 75.54 112.473 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 18.5 m-85 -64.54 160.21 53.98 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.682 0.753 . . . . 73.44 110.844 -179.854 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 96.06 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.689 2.259 . . . . 63.03 112.357 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.76 -41.23 0.94 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.746 -0.74 . . . . 75.22 112.506 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -40.28 84.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.71 0.291 . . . . 74.44 110.877 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -83.75 -26.37 29.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 74.21 110.896 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -66.28 173.17 3.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 62.55 111.108 179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.02 113.01 30.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 74.42 111.129 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 46.6 mt -102.29 132.96 47.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 74.33 111.096 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -127.76 141.77 51.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.14 -0.482 . . . . 72.35 111.154 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -92.92 126.15 37.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.266 -0.424 . . . . 74.14 110.921 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 92.8 t -116.35 99.22 7.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 74.24 111.118 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.24 113.71 10.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 75.3 110.892 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -94.3 160.31 32.17 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.588 0.709 . . . . 63.43 111.091 179.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.82 74.53 1.31 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.687 2.258 . . . . 73.31 112.305 -179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.5 t -177.0 137.17 0.23 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 74.13 111.171 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.77 28.1 3.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 74.4 111.116 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.43 -34.66 3.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 73.42 111.06 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 15.4 m-85 -147.97 166.37 27.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.417 . . . . 63.21 110.872 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -140.35 159.67 41.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 71.53 110.868 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 9.3 mt-10 -93.24 141.47 28.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 75.04 110.881 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -127.31 124.34 38.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 74.1 110.869 -179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.23 111.58 23.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.121 -0.491 . . . . 75.21 110.936 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.5 t -104.17 117.0 49.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 73.23 111.094 179.883 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 5.3 ttmm -97.87 109.3 22.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.899 179.89 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.5 mt -131.71 154.38 81.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.657 0.741 . . . . 72.25 110.893 179.92 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 162.17 43.11 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.661 2.241 . . . . 72.43 112.352 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 105.28 1.47 Allowed 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.648 2.232 . . . . 73.3 112.361 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.7 mt -107.32 -171.06 1.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 74.1 110.937 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 46.4 t -71.18 151.24 44.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 52.51 110.862 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.93 -47.54 64.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 75.54 110.877 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -58.38 -41.05 83.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.162 -0.472 . . . . 73.12 110.913 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -64.44 -53.32 50.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 72.3 110.894 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 8.9 mtt85 -53.28 -52.99 57.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 73.31 110.908 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.2 mt -63.85 -34.42 77.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.183 -0.462 . . . . 73.43 110.894 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -65.86 -46.79 77.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 73.03 110.9 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 26.3 tp -64.86 -51.09 63.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.133 -0.485 . . . . 75.31 110.913 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -56.68 -49.39 75.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.455 . . . . 55.43 110.885 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -58.0 -53.41 58.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.462 . . . . 74.5 110.898 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 9.3 mt -52.79 -43.27 65.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 75.42 110.912 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.55 -56.51 20.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 75.03 110.88 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.58 -13.23 60.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.119 -0.492 . . . . 73.43 111.073 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 23.2 t -79.55 -56.96 3.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 74.05 110.87 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -88.33 -52.2 5.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 64.14 110.875 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.9 tp -67.9 -12.28 60.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.129 -0.487 . . . . 70.44 110.893 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt 57.58 23.32 9.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 73.11 110.903 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -65.3 -179.73 0.64 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.437 . . . . 64.41 111.092 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 86.2 m -145.12 110.94 5.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.1 111.146 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 62.1 t -57.59 126.76 15.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 75.43 111.122 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 82.5 mt -110.72 -48.21 3.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 72.55 110.923 179.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -144.27 168.89 18.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 63.45 111.133 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 84.5 p -169.48 143.67 2.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 61.42 110.893 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 18.9 mt-10 -136.38 143.23 43.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 64.33 110.883 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 44.8 m -135.66 146.55 47.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 72.23 111.131 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 35.8 t -121.77 97.0 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 74.13 111.158 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 C-N-CA 120.734 -0.746 . . . . 65.2 112.499 179.982 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 9.7 mtm . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.813 0.339 . . . . 71.11 110.887 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 34.9 m -121.9 160.12 23.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 72.11 111.156 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -103.48 -168.94 25.64 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.728 -0.749 . . . . 74.42 112.469 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -164.36 132.72 3.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.865 0.364 . . . . 75.13 110.866 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -171.09 153.5 3.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 73.52 110.861 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -167.67 145.9 4.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 75.33 110.943 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 84.6 p -168.81 131.2 1.3 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 74.43 110.888 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -123.44 154.22 29.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 71.3 111.138 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -161.72 110.45 1.5 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.475 . . . . 62.44 110.858 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -55.19 102.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 75.23 110.857 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 12.0 t -148.76 166.21 29.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.114 -0.494 . . . . 73.35 111.148 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -68.7 -60.36 5.42 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.77 -0.729 . . . . 52.35 112.51 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 133.72 161.41 9.68 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.731 -0.747 . . . . 51.4 112.47 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 93.2 m -119.4 113.35 20.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 74.44 111.161 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -98.2 123.2 42.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 75.14 111.127 179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -111.48 112.35 24.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 71.34 110.92 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.45 111.48 23.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.112 -0.495 . . . . 75.03 111.144 -179.96 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -130.04 142.93 50.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.945 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.6 135.79 35.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 61.01 110.863 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -144.37 170.88 15.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 62.23 111.044 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -62.32 160.55 31.68 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.671 0.748 . . . . 74.21 110.87 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -19.7 35.76 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.717 2.278 . . . . 74.22 112.337 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -64.99 -46.85 79.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 75.32 110.904 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 54.1 t -64.32 121.79 14.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 73.42 111.122 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -117.28 177.26 4.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 75.54 110.91 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 83.3 t -52.15 -48.47 42.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 74.42 111.153 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -52.35 -43.88 64.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 71.53 110.87 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 38.6 m -66.84 -41.96 86.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.48 . . . . 74.25 111.171 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 6.7 mt -63.57 -50.88 67.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.956 179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 27.6 ptt180 -64.64 -35.96 82.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 65.12 110.89 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -64.7 -45.57 86.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.169 -0.469 . . . . 74.05 110.843 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -70.03 -35.98 74.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.902 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 26.4 mt -63.6 -52.79 59.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 74.5 110.929 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -68.23 -38.0 81.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 71.14 110.891 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.22 -45.76 92.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 74.42 110.868 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -68.57 -23.68 64.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 75.01 110.87 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.08 -19.07 18.24 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.694 -0.765 . . . . 73.42 112.475 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 15.5 m-85 -64.7 160.24 55.16 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.648 0.737 . . . . 74.42 110.86 -179.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 97.43 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.705 2.27 . . . . 71.43 112.34 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -111.56 -35.03 1.96 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.728 -0.749 . . . . 72.51 112.474 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -64.66 -51.88 60.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.736 0.303 . . . . 73.53 110.906 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -71.66 -33.24 68.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 63.41 110.851 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -64.44 170.83 3.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.169 -0.469 . . . . 72.4 111.082 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.0 111.67 26.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 70.24 111.162 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 44.4 mt -97.53 119.89 46.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 73.15 111.164 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.24 155.43 27.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 73.24 111.128 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -114.71 142.24 46.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 63.11 110.902 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 61.8 t -134.55 113.42 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 75.05 111.156 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.19 102.18 1.63 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.135 -0.484 . . . . 75.22 110.887 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -74.0 160.27 82.15 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.616 0.722 . . . . 71.42 111.091 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.83 74.6 1.31 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.661 2.241 . . . . 75.42 112.335 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t 179.59 141.45 0.13 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 70.54 111.14 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -96.03 26.64 4.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 74.01 111.095 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.56 -35.06 3.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 71.44 111.083 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -140.03 178.57 7.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.441 . . . . 70.15 110.91 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 47.8 mtm180 -149.73 157.23 43.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 72.3 110.875 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -94.1 152.65 18.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 73.24 110.875 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 80.7 m-85 -139.76 129.72 24.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 64.51 110.873 -179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -103.41 109.01 20.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.186 -0.461 . . . . 74.24 110.944 179.973 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.6 t -96.09 115.47 35.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 72.13 111.137 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -94.97 107.44 19.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.158 -0.474 . . . . 72.23 110.895 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.8 mt -132.36 154.29 81.53 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.625 0.726 . . . . 74.23 110.934 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 162.12 43.31 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.704 2.269 . . . . 75.24 112.35 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 104.16 1.29 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.664 2.243 . . . . 73.11 112.326 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.2 mt -104.36 -171.3 1.9 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 73.05 110.943 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 30.5 m -70.24 150.87 45.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 72.22 110.841 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -52.29 -47.32 65.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 61.24 110.858 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -60.91 -49.95 75.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 73.34 110.878 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -55.24 -55.5 30.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 71.14 110.834 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 71.8 mtp180 -53.2 -52.99 57.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.467 . . . . 72.44 110.894 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 -35.2 72.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.191 -0.459 . . . . 74.32 110.907 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -65.92 -45.63 81.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 73.12 110.868 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 22.8 tp -63.38 -51.07 67.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.114 -0.494 . . . . 73.13 110.912 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -57.36 -50.02 74.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 75.21 110.893 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -57.96 -53.5 57.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.467 . . . . 74.42 110.853 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.0 tt -52.68 -43.23 65.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 75.32 110.898 -179.949 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.66 -56.54 20.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 75.43 110.876 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.36 -13.32 60.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 72.44 111.09 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 25.1 t -79.64 -57.29 3.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 62.31 110.85 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -88.33 -52.29 5.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 60.21 110.912 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.77 -12.44 60.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 73.12 110.966 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm 57.49 23.26 8.92 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.461 . . . . 71.45 110.882 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.29 178.7 1.43 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 63.22 111.142 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 42.4 m -143.89 110.98 5.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 73.4 111.144 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.9 t -58.18 104.01 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 74.22 111.145 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 25.1 mt -81.49 -39.08 25.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 73.02 110.926 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.59 173.2 13.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 74.45 111.083 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 1.3 t -166.06 155.81 12.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 72.45 110.87 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 7.0 pt-20 -149.55 141.69 24.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.47 . . . . 74.52 110.884 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 27.7 m -141.31 145.72 35.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 74.04 111.151 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 24.1 t -98.82 109.69 24.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 74.32 111.129 179.876 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 C-N-CA 120.721 -0.752 . . . . 75.34 112.472 179.946 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 23.2 mtt . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.784 0.326 . . . . 63.11 110.897 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 22.5 m -116.98 139.86 42.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 73.4 111.133 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 136.85 -106.0 0.53 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.695 -0.764 . . . . 74.5 112.472 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 55.02 31.73 16.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.901 0.381 . . . . 74.13 110.895 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -111.71 62.94 0.62 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 73.32 110.913 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -115.14 104.57 11.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 73.41 110.898 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 5.2 m -129.36 125.26 36.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 71.03 110.87 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 62.9 mt -96.18 145.28 8.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 72.35 111.122 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -114.87 -21.7 9.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.485 . . . . 74.51 110.897 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 27.2 t80 -122.28 -72.28 0.69 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.117 -0.492 . . . . 74.33 110.846 -179.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 14.6 t -161.92 173.37 14.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 74.43 111.113 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 145.86 110.21 0.65 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.706 -0.759 . . . . 52.14 112.465 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -135.36 160.85 24.56 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.759 -0.734 . . . . 54.31 112.503 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 92.1 m -122.04 110.72 16.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.8 0.333 . . . . 74.43 111.168 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.6 142.6 27.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 74.41 111.069 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -133.89 108.92 8.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 73.32 110.899 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 2.5 m -93.96 119.19 32.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 74.21 111.185 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -131.3 156.55 45.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 74.15 110.93 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -106.17 150.07 26.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 75.54 110.839 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -157.31 171.69 19.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 63.11 111.088 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.24 160.6 56.57 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.653 0.739 . . . . 72.42 110.881 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 -15.23 36.72 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.663 2.242 . . . . 72.21 112.338 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -62.82 -50.74 69.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.219 -0.446 . . . . 73.41 110.872 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.36 148.64 6.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 74.52 111.112 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -137.32 172.97 12.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.484 . . . . 73.45 110.875 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 87.2 t -51.41 -50.01 29.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 71.4 111.1 -179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -53.27 -40.39 64.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 73.44 110.918 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.4 m -68.36 -41.4 80.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 53.21 111.106 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 6.6 mt -60.51 -51.24 70.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.243 -0.435 . . . . 74.02 110.921 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -64.73 -42.95 94.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 74.41 110.902 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -59.85 -38.05 81.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.466 . . . . 75.25 110.835 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -72.04 -44.61 63.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 73.13 110.863 -179.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 40.1 mt -57.02 -48.89 77.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.464 . . . . 72.13 110.939 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -71.5 -37.99 71.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 75.14 110.88 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -55.28 -49.19 72.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 65.43 110.868 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.35 -25.92 67.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.468 . . . . 72.0 110.939 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 112.44 -7.29 26.5 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.748 -0.739 . . . . 64.22 112.495 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -71.45 160.31 82.95 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.656 0.741 . . . . 72.12 110.87 -179.841 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 79.93 0.91 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.667 2.245 . . . . 72.42 112.368 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -95.81 -37.18 5.05 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.748 -0.739 . . . . 73.12 112.47 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 11.5 pttp -59.34 -43.62 92.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.771 0.319 . . . . 75.14 110.875 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -81.18 -33.31 33.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 74.41 110.846 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -54.87 169.64 0.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 61.35 111.107 179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 34.0 t -127.11 110.83 23.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 74.43 111.144 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 56.5 mt -92.91 128.76 44.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 74.2 111.12 179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.95 136.54 52.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 72.35 111.138 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -99.16 132.93 44.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 74.41 110.881 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 33.1 t -139.54 111.42 5.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 72.33 111.105 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.78 98.52 8.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 75.25 110.896 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -65.08 161.22 50.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.609 0.718 . . . . 74.21 111.112 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 71.13 1.52 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.699 2.266 . . . . 74.14 112.372 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.8 t 177.81 136.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 74.55 111.161 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -93.96 38.63 1.08 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 73.23 111.064 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -124.42 -35.28 2.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 73.44 111.092 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -139.85 177.26 8.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.277 -0.42 . . . . 74.54 110.906 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.45 152.65 44.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 65.2 110.911 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -111.67 130.97 55.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 75.34 110.876 -179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -132.93 135.41 45.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 74.23 110.87 -179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -103.92 112.22 25.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 73.54 110.893 -179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 14.5 t -95.28 111.08 25.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 72.3 111.141 179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 14.1 tttm -87.76 115.18 25.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 72.42 110.904 179.936 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.1 mt -131.78 154.88 81.92 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.644 0.735 . . . . 74.21 110.899 179.959 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 162.73 40.92 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.707 2.271 . . . . 65.31 112.379 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 103.91 1.23 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.698 2.266 . . . . 70.35 112.392 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.0 mt -107.22 -170.96 1.79 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 73.51 110.935 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.3 t -71.83 150.43 44.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 64.12 110.874 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -48.92 64.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 64.54 110.904 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -60.55 -48.41 81.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.888 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 49.4 mmm-85 -54.47 -57.96 9.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 73.21 110.885 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -52.86 -52.58 56.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 74.33 110.908 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mt -56.36 -37.12 69.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 71.0 110.928 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -64.84 -46.16 83.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 72.31 110.872 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 24.9 tp -60.91 -51.13 70.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 74.15 110.907 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.36 -50.33 73.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 73.45 110.857 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -58.0 -51.88 67.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.14 110.867 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.6 tt -52.83 -44.78 66.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.229 -0.441 . . . . 74.01 110.88 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -60.05 -56.42 21.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 74.21 110.898 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.23 -13.14 59.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 74.03 111.103 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 23.2 t -79.63 -57.77 3.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 75.31 110.803 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -88.42 -52.12 5.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.093 -0.503 . . . . 75.43 110.874 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.82 -12.51 60.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.32 110.912 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt 57.09 23.39 8.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.185 -0.462 . . . . 74.35 110.924 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -68.65 176.93 2.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 72.13 111.071 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.7 m -145.09 110.96 5.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 73.32 111.098 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.5 t -54.14 135.11 16.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 74.15 111.1 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 77.6 mt -120.79 -47.64 2.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 71.25 110.877 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -133.88 165.84 24.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 71.02 111.069 179.83 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 80.3 p -171.69 138.48 1.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 62.12 110.84 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 6.0 pt-20 -140.91 139.7 34.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.33 110.888 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 88.7 m -124.95 146.04 49.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.41 111.141 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 22.0 t -134.84 123.7 41.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 75.51 111.1 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 C-N-CA 120.754 -0.736 . . . . 71.54 112.504 -179.978 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 2.9 mmt . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.812 0.339 . . . . 75.23 110.855 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 28.8 m -76.81 134.65 28.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 75.43 111.128 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -153.18 75.96 0.23 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.718 -0.753 . . . . 70.22 112.474 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -150.02 151.31 33.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.822 0.344 . . . . 71.54 110.943 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -129.4 144.3 51.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 74.1 110.869 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 25.2 p90 -148.01 135.72 20.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 73.14 110.921 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 20.0 m -120.64 121.46 38.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.116 -0.493 . . . . 60.13 110.827 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 41.6 mt -117.27 141.65 34.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 75.35 111.161 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -166.03 119.83 1.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 74.43 110.877 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 21.6 p90 -123.39 127.29 48.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 73.33 110.88 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 20.2 m -106.74 70.05 0.8 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.117 -0.492 . . . . 72.03 111.137 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 128.78 -83.26 0.33 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.74 -0.743 . . . . 72.44 112.51 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 138.1 153.75 6.34 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.723 -0.751 . . . . 71.23 112.476 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 94.4 m -128.72 110.26 12.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.746 0.308 . . . . 74.12 111.154 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -96.81 130.1 44.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 74.11 111.094 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -117.56 116.45 27.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.217 -0.447 . . . . 75.41 110.923 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -98.81 110.04 22.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 72.1 111.158 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.9 pt? -133.37 145.64 50.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 71.43 110.89 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -89.29 137.72 32.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 75.23 110.911 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -133.27 167.09 21.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 74.23 111.097 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -65.35 160.61 57.32 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.667 0.746 . . . . 71.43 110.862 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -12.79 33.6 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 2.251 . . . . 70.03 112.334 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -81.78 -37.29 27.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 73.44 110.861 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 87.8 t -70.75 120.67 19.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 63.22 111.143 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -113.49 178.72 4.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 74.14 110.883 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 54.1 t -53.46 -48.66 57.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 75.45 111.146 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -51.88 -42.08 62.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 71.31 110.875 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 69.6 m -67.84 -39.97 83.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.476 . . . . 71.45 111.139 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 2.3 mt -61.87 -50.94 70.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 70.22 110.899 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -64.79 -42.21 95.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.459 . . . . 75.25 110.859 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -60.04 -40.51 89.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.43 110.885 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 15.0 t80 -70.9 -43.27 68.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 74.04 110.871 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 34.1 mt -57.78 -49.52 76.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 72.12 110.881 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.79 -37.96 73.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 75.0 110.872 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -56.38 -49.18 75.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 74.3 110.865 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -24.52 65.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 74.51 110.914 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -16.88 20.23 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.755 -0.736 . . . . 53.51 112.491 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.9 m-85 -60.94 160.24 21.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.658 0.742 . . . . 74.3 110.876 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 86.42 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.724 2.283 . . . . 74.12 112.333 179.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -102.04 -30.54 5.69 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.747 -0.739 . . . . 72.22 112.452 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -63.94 -42.22 97.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.766 0.317 . . . . 74.21 110.871 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -85.53 -27.19 25.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 74.41 110.854 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -62.34 165.6 5.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 62.44 111.104 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.83 111.28 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 73.5 111.092 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 54.3 mt -92.8 139.5 17.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 73.44 111.128 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -135.47 143.68 45.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 73.03 111.122 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -99.3 143.23 29.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 74.31 110.883 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 76.8 t -139.01 115.11 9.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.452 . . . . 74.42 111.119 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -74.63 127.3 32.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 74.14 110.868 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -110.41 160.22 29.25 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.563 0.697 . . . . 70.53 111.135 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 74.48 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.692 2.262 . . . . 72.44 112.356 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.0 t 179.17 141.58 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.462 . . . . 73.34 111.122 -179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -99.56 27.41 5.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 71.04 111.089 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.48 -35.02 3.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 73.11 111.068 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 13.1 m-85 -146.8 159.98 42.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.275 -0.421 . . . . 75.12 110.943 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 4.6 ptt180 -131.18 165.02 24.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.09 -0.505 . . . . 74.03 110.867 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -92.84 139.94 30.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 64.02 110.869 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 10.8 m-85 -128.83 122.86 31.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.486 . . . . 73.54 110.851 -179.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -102.31 105.54 16.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.104 -0.498 . . . . 75.43 110.916 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.4 t -96.82 133.52 37.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 75.05 111.084 179.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 18.9 tttp -108.55 108.1 18.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 72.41 110.929 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.6 mt -131.17 154.44 81.99 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.577 0.703 . . . . 75.52 110.898 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.16 43.14 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.678 2.252 . . . . 72.51 112.383 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 113.92 3.53 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.637 2.224 . . . . 74.41 112.354 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 1.2 mt -115.37 -171.19 1.91 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 74.55 110.907 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.32 154.98 38.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 73.23 110.848 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . 0.479 ' N ' HH21 ' A' ' 537' ' ' ARG . 4.6 m-20 -51.67 -47.11 63.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.101 -0.5 . . . . 75.13 110.855 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -59.78 -50.17 74.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 71.31 110.863 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -50.88 -59.11 4.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 72.31 110.897 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . 0.479 HH21 ' N ' ' A' ' 534' ' ' ASP . 79.4 mtm180 -53.51 -52.51 59.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 72.31 110.864 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.38 -39.32 67.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 73.24 110.931 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -67.23 -47.34 71.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.467 . . . . 72.43 110.879 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -60.01 -51.09 71.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.14 110.92 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -59.47 -48.33 82.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 74.23 110.939 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 23.8 mtp180 -60.13 -53.52 56.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 73.51 110.869 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 4.0 tt -52.9 -44.03 66.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 74.34 110.902 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.39 -56.48 20.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 74.35 110.875 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.36 -13.2 60.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 72.53 111.103 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.52 -57.34 3.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 73.11 110.898 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -88.33 -52.24 5.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.495 . . . . 71.11 110.914 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.1 tp -67.88 -12.35 60.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 74.34 110.945 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt 57.44 23.22 8.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 73.22 110.893 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.99 179.44 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 63.41 111.113 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 61.5 m -139.67 110.99 7.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 72.11 111.188 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.41 114.52 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 74.11 111.145 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 12.2 mt -90.92 -51.66 5.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 75.14 110.856 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -162.0 174.21 13.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 74.11 111.092 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 90.7 p -163.06 148.43 11.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 74.31 110.887 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -136.15 128.74 30.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 70.03 110.889 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 61.7 m -116.31 145.95 42.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.121 -0.49 . . . . 64.23 111.15 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 23.9 t -125.14 114.46 40.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 72.43 111.097 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.732 -0.747 . . . . 74.32 112.486 179.969 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.813 0.34 . . . . 72.43 110.85 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 11.5 p -81.26 -28.63 10.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 72.5 111.13 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 58.36 -150.58 33.54 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.722 -0.751 . . . . 63.3 112.477 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -127.5 158.79 36.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.899 0.381 . . . . 73.44 110.884 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -99.34 121.05 40.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 72.14 110.912 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -81.18 -175.39 5.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.22 -0.445 . . . . 74.14 110.958 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 8.4 m -138.45 115.15 10.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.147 -0.478 . . . . 73.22 110.86 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 28.4 mm -98.96 136.78 28.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.48 . . . . 73.43 111.122 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -77.89 -21.9 50.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 71.31 110.863 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 41.5 p90 -110.46 175.09 5.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 74.22 110.907 -179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 92.0 m -160.83 143.72 12.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 72.32 111.129 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 176.26 -107.58 0.24 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.774 -0.727 . . . . 65.22 112.502 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -172.64 160.32 31.37 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.719 -0.753 . . . . 75.42 112.478 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 25.6 m -131.6 107.35 8.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.8 0.333 . . . . 73.22 111.162 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.0 115.15 27.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 74.03 111.084 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -104.69 113.03 26.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 74.42 110.93 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 5.2 m -94.87 110.09 22.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.129 -0.487 . . . . 72.32 111.127 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -134.41 143.28 47.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 71.41 110.939 179.966 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 24.3 mtp180 -90.21 142.15 28.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 74.42 110.834 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -137.15 168.54 19.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.172 -0.467 . . . . 73.13 111.065 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -63.94 160.57 45.67 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.617 0.722 . . . . 64.02 110.908 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -14.12 35.49 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.666 2.244 . . . . 75.43 112.322 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -80.17 -37.33 33.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 73.15 110.904 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 63.9 t -69.2 125.64 27.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.453 . . . . 74.12 111.169 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -117.99 175.35 5.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 74.41 110.873 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 60.9 t -51.79 -48.9 37.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 74.34 111.114 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -52.0 -40.38 60.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 54.15 110.918 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 95.2 m -66.47 -43.23 86.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.134 -0.485 . . . . 75.34 111.111 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 7.2 mt -61.78 -51.04 69.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 71.35 110.924 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -65.02 -35.09 80.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 74.15 110.841 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 42.6 mtp180 -64.19 -45.09 89.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.244 -0.435 . . . . 74.31 110.859 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -71.15 -36.92 72.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 71.22 110.9 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 29.2 mt -62.11 -50.43 71.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.962 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -71.08 -37.87 72.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 70.24 110.873 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.09 -48.95 78.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 73.45 110.905 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -67.88 -24.05 65.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 72.55 110.865 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 113.91 -18.6 19.11 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.745 -0.741 . . . . 63.01 112.472 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 15.9 m-85 -60.74 160.24 20.92 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.684 0.754 . . . . 74.11 110.884 -179.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 90.08 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.683 2.255 . . . . 61.2 112.362 -179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -104.95 -39.26 2.35 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.788 -0.72 . . . . 61.12 112.501 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 17.1 mtpp -57.25 -52.08 66.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.728 0.299 . . . . 75.41 110.883 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.14 -36.27 66.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.426 . . . . 71.42 110.893 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -54.14 167.06 0.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 73.43 111.1 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.72 111.12 24.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 72.1 111.163 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 74.7 mt -96.02 127.05 48.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 72.34 111.141 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 2.1 m -122.13 148.21 45.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 74.3 111.193 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -104.41 140.35 38.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 72.34 110.925 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 80.8 t -136.43 111.91 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 65.04 111.177 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.09 110.93 7.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 74.33 110.924 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -91.51 160.25 37.16 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.547 0.689 . . . . 73.52 111.104 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 74.55 1.29 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.673 2.249 . . . . 75.31 112.346 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.9 t -177.04 137.37 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 73.32 111.149 -179.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.42 25.8 4.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 75.23 111.101 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.38 -35.15 3.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 64.34 111.072 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -144.58 166.77 24.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 72.2 110.906 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -136.32 160.23 39.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.492 . . . . 75.33 110.853 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -88.97 138.39 31.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 53.55 110.906 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -128.76 122.2 30.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 63.44 110.881 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -99.3 104.82 16.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 75.44 110.905 -179.983 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.6 t -96.57 111.86 27.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 71.23 111.112 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 17.3 ttmt -91.38 109.05 20.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.15 110.86 179.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 6.0 mt -132.53 154.42 81.52 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.618 0.723 . . . . 74.35 110.921 179.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 162.19 43.04 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.714 2.276 . . . . 72.52 112.349 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 103.88 1.23 Allowed 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.684 2.256 . . . . 74.02 112.344 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 5.0 mt -101.06 -171.34 1.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 74.21 110.884 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 30.0 t -71.12 151.25 44.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 73.35 110.875 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -51.75 -51.14 58.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 63.41 110.873 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -61.14 -45.41 94.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.436 . . . . 72.11 110.924 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 11.6 mmt180 -57.38 -58.07 9.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 74.34 110.87 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -52.82 -52.15 58.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 73.4 110.908 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.4 mt -56.86 -48.12 78.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 73.32 110.9 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.8 -41.63 74.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 74.22 110.908 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 34.5 tp -66.38 -39.71 89.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.136 -0.484 . . . . 75.04 110.904 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -61.23 -55.4 32.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 75.51 110.836 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 1.6 ptt85 -59.07 -47.83 83.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 75.22 110.849 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 5.5 tt -53.59 -47.34 70.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.439 . . . . 75.5 110.898 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -60.63 -56.04 26.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 73.34 110.867 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.48 -14.09 55.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 75.13 111.138 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.03 -59.28 2.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 75.43 110.798 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -86.23 -52.55 5.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 74.43 110.87 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.2 tp -67.53 -12.67 60.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.456 . . . . 71.42 110.93 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.27 23.2 8.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 72.13 110.9 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -68.68 175.4 3.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 71.41 111.075 179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 88.9 m -137.55 111.18 8.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 74.43 111.148 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.2 111.81 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 73.44 111.167 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 12.1 mt -90.15 -51.96 5.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 63.12 110.881 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.4 175.12 13.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 75.21 111.09 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 91.9 p -163.72 139.34 6.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 70.32 110.837 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -134.02 147.75 51.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 73.52 110.843 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 63.1 m -142.9 139.69 30.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.091 -0.504 . . . . 70.11 111.126 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 23.6 t -102.6 116.02 45.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 74.24 111.139 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 C-N-CA 120.741 -0.742 . . . . 65.41 112.503 -179.989 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.828 0.347 . . . . 73.4 110.856 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 27.9 m -120.99 -177.15 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 74.55 111.124 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -149.23 90.91 0.14 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.754 -0.736 . . . . 64.43 112.48 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -130.75 98.82 4.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.876 0.369 . . . . 73.02 110.877 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -163.44 151.87 13.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 71.3 110.865 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -123.9 -176.22 3.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.22 -0.445 . . . . 72.12 110.914 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 4.1 t -90.78 168.5 11.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 74.3 110.88 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 29.5 mm -94.62 137.24 23.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 73.32 111.143 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -80.91 -21.51 40.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 71.44 110.82 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 74.5 m-85 -92.79 152.42 19.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 72.42 110.908 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 1.7 m -136.51 135.66 38.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 75.31 111.113 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -160.05 -106.46 0.22 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.797 -0.716 . . . . 73.23 112.508 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -159.95 148.31 16.62 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.766 -0.731 . . . . 52.33 112.498 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 1.6 m -123.94 109.21 13.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.776 0.322 . . . . 74.54 111.175 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -94.87 121.98 37.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 73.42 111.103 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -115.95 114.6 24.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.439 . . . . 72.31 110.934 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -100.06 113.55 26.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.095 -0.502 . . . . 75.41 111.158 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -131.64 143.86 50.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 75.34 110.861 179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -92.14 145.25 24.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.467 . . . . 73.01 110.846 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -148.66 169.76 19.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 73.21 111.139 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -64.97 160.8 52.97 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.657 0.741 . . . . 75.51 110.925 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -10.74 29.3 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.691 2.261 . . . . 74.45 112.385 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -73.85 -46.45 44.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 71.54 110.853 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 67.0 t -66.92 138.86 22.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.11 111.121 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -133.73 179.71 6.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 64.2 110.903 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.6 t -51.54 -47.93 36.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 72.23 111.093 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -51.65 -39.99 59.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.4 110.879 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.2 m -71.31 -35.53 71.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 70.13 111.141 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 4.1 mt -67.32 -45.57 76.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 75.13 110.898 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -69.47 -46.26 67.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 74.22 110.898 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -64.12 -32.47 74.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 73.32 110.891 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -73.28 -46.99 46.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 72.12 110.85 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 43.4 mt -61.08 -42.53 98.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 75.03 110.941 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -73.05 -37.59 66.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 73.05 110.891 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -60.34 -48.98 79.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 72.4 110.88 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 28.8 mmmt -68.97 -23.78 64.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 72.34 110.875 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.12 -17.6 19.41 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.746 -0.74 . . . . 70.45 112.493 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -63.05 160.16 41.11 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.593 0.711 . . . . 75.21 110.943 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 95.57 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 122.689 2.259 . . . . 65.54 112.325 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -111.15 -37.24 1.68 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.695 -0.764 . . . . 74.43 112.482 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -63.34 -42.56 98.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.791 0.329 . . . . 65.23 110.874 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -79.91 -38.43 32.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 73.42 110.938 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -55.94 171.44 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 73.43 111.115 179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 56.4 t -127.08 118.08 49.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.272 -0.422 . . . . 75.02 111.159 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 50.7 mt -96.82 141.84 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 74.33 111.151 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.89 138.72 37.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.13 111.173 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.53 143.17 27.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 53.13 110.956 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 83.7 t -135.77 104.61 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 75.23 111.11 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 18.9 tm0? -73.84 102.08 3.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 75.51 110.894 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -81.92 160.23 63.98 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.595 0.712 . . . . 75.12 111.089 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 74.55 1.29 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.629 2.22 . . . . 71.24 112.356 -179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 4.4 t -175.05 139.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 72.23 111.187 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.63 25.18 6.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 72.35 111.083 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.85 -34.57 3.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 73.13 111.11 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -138.6 177.61 7.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.242 -0.435 . . . . 74.21 110.944 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 44.2 mtt85 -144.78 153.66 41.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 75.51 110.875 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -92.27 138.74 31.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 71.45 110.878 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 9.6 m-85 -122.25 122.77 39.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.138 -0.483 . . . . 75.22 110.868 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -100.46 101.48 12.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.15 110.944 -179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 19.7 t -95.98 122.7 47.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 74.32 111.128 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -100.63 109.65 21.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.478 . . . . 74.21 110.874 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.8 mt -130.77 154.65 81.9 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.583 0.706 . . . . 75.35 110.915 179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 162.41 42.18 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.66 2.24 . . . . 62.14 112.379 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 104.04 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.667 2.245 . . . . 75.32 112.346 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.6 mt -103.0 -171.0 1.87 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 73.14 110.895 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 21.3 m -75.69 152.59 37.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 64.32 110.853 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.64 -46.77 63.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 75.24 110.918 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.03 -43.1 99.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 74.32 110.915 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -62.0 -55.8 25.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 75.34 110.877 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 45.9 mtp180 -52.79 -53.15 52.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 74.23 110.895 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -55.38 -48.3 74.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 73.53 110.975 -179.988 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -55.55 -41.84 73.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.23 110.948 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 30.4 tp -66.0 -39.2 90.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.082 -0.508 . . . . 74.42 110.901 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -61.74 -55.63 28.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.185 -0.461 . . . . 75.41 110.919 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 17.2 ptp180 -58.55 -47.95 82.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.096 -0.502 . . . . 75.21 110.89 -179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 12.2 mt -53.72 -47.92 70.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 73.22 110.945 179.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -59.62 -56.26 24.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.166 -0.47 . . . . 74.22 110.877 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.06 -13.54 58.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 74.34 111.082 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -59.03 2.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.889 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -88.2 -52.22 5.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 72.42 110.896 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -67.63 -12.73 61.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 73.55 110.991 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt 55.89 24.22 7.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 74.33 110.942 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.81 -179.94 3.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.232 -0.44 . . . . 72.33 111.104 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.7 m -145.05 111.37 5.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 74.3 111.096 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.5 t -52.08 120.23 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 65.02 111.138 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 16.0 mt -99.0 -50.91 4.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 72.41 110.88 179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -159.11 174.71 14.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.447 . . . . 72.54 111.131 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 51.1 p -161.04 163.51 31.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 63.0 110.857 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 18.5 pt-20 -155.26 136.38 13.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 73.22 110.88 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 2.6 m -130.05 144.27 51.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 74.45 111.157 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.68 111.95 35.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 74.13 111.112 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 C-N-CA 120.771 -0.728 . . . . 52.22 112.511 179.991 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 6.3 tpt . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.836 0.351 . . . . 74.11 110.89 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 20.3 m -80.95 159.48 4.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.248 -0.433 . . . . 73.44 111.147 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 170.64 78.74 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.748 -0.739 . . . . 74.52 112.471 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -111.79 99.03 7.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.882 0.373 . . . . 75.23 110.896 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -95.63 -48.33 5.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 74.43 110.919 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -145.27 159.61 42.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 74.53 110.909 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 11.1 p -147.69 120.3 8.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.124 -0.489 . . . . 63.22 110.832 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 34.8 mm -109.69 143.65 19.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 73.33 111.116 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -160.26 108.87 1.69 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 74.32 110.878 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -108.83 171.74 7.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 73.23 110.831 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 14.9 t -110.96 152.72 26.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.108 -0.496 . . . . 55.41 111.143 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 137.59 -86.28 0.23 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 64.14 112.501 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 130.8 146.42 5.88 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 63.22 112.471 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 9.3 m -125.17 113.65 17.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.811 0.339 . . . . 72.11 111.133 -179.868 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.06 121.18 36.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 65.12 111.096 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -114.01 110.18 19.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 72.34 110.921 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.5 m -97.77 120.21 37.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 72.24 111.123 -179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -136.96 153.2 50.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 72.52 110.888 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 2.5 ttm180 -98.89 137.87 36.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.454 . . . . 70.32 110.864 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -146.52 168.06 22.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 75.44 111.104 179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.56 160.75 49.76 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.608 0.718 . . . . 72.55 110.9 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -15.86 37.08 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.653 2.235 . . . . 75.43 112.322 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -66.64 -47.48 72.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 74.03 110.847 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 38.7 t -67.87 129.63 32.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 73.34 111.123 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -122.6 177.77 5.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 75.45 110.844 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 87.1 t -51.5 -49.53 32.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 74.24 111.132 179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -50.78 -40.36 54.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 73.53 110.841 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 91.5 m -70.57 -35.14 72.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 73.24 111.137 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 496' ' ' LEU . . . . . . . . . . . . . 4.5 mt -68.02 -44.19 77.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 73.01 110.887 179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -69.39 -45.04 70.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 73.31 110.916 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -66.48 -32.78 74.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 74.44 110.876 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -73.6 -42.67 61.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.916 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 52.9 mt -65.53 -41.56 92.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 72.23 110.934 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -73.07 -37.76 66.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.41 110.88 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -64.02 -46.32 84.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 74.53 110.877 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -65.88 -24.76 66.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 73.22 110.941 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.01 -16.06 20.73 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.717 -0.754 . . . . 74.22 112.487 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.2 m-85 -71.94 160.27 83.15 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.66 0.743 . . . . 74.44 110.877 -179.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 98.44 0.69 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.676 2.25 . . . . 61.12 112.313 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -116.27 -34.59 1.31 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.779 -0.724 . . . . 62.52 112.495 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 3.7 mtmp? -62.39 -50.56 71.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.779 0.323 . . . . 72.35 110.907 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -73.02 -32.85 65.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 73.32 110.897 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 510' ' ' ALA . . . . . . . . . . . . . . . -59.75 172.94 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.138 -0.483 . . . . 73.35 111.097 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.03 119.37 52.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.225 -0.443 . . . . 74.23 111.145 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 44.2 mt -99.28 141.9 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 74.44 111.141 179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.06 134.3 36.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 75.32 111.128 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 12.5 pm0 -94.89 142.74 27.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 72.2 110.949 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.8 t -138.21 114.33 10.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 74.34 111.183 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.08 113.01 10.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 75.1 110.88 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 517' ' ' ALA . . . . . . . . . . . . . . . -91.76 160.34 36.43 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.616 0.722 . . . . 54.44 111.055 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 518' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 74.43 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.673 2.249 . . . . 75.53 112.375 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 3.0 t -179.32 141.02 0.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 73.55 111.145 -179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -97.33 24.76 6.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.253 -0.431 . . . . 65.22 111.125 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.63 -35.67 2.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 71.03 111.041 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 7.4 m-85 -137.58 168.14 20.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 74.21 110.887 -179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 10.6 mmt85 -140.67 160.03 40.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.094 -0.503 . . . . 75.15 110.884 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -90.52 139.48 30.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 64.41 110.89 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 89.9 m-85 -128.47 124.63 36.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.486 . . . . 74.21 110.859 -179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -106.35 104.31 13.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.465 . . . . 74.04 110.907 179.996 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 21.2 t -96.86 127.04 49.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 71.33 111.154 179.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 528' ' ' LYS . . . . . . . . . . . . . 3.1 tmtm? -106.44 108.32 19.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 54.21 110.885 179.939 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 529' ' ' LEU . . . . . . . . . . . . . 5.3 mt -130.58 154.73 81.76 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.631 0.729 . . . . 73.34 110.873 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 162.39 42.28 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.675 2.25 . . . . 74.02 112.331 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 104.05 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.701 2.267 . . . . 53.32 112.337 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.7 mt -103.78 -170.9 1.84 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 63.12 110.961 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 32.5 t -72.98 151.09 41.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 71.32 110.865 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.06 -46.31 65.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 51.52 110.82 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -61.11 -53.55 55.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 72.2 110.888 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 42.2 mmt180 -52.04 -55.79 18.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.458 . . . . 75.22 110.885 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 -52.93 -53.2 52.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 65.03 110.878 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.2 -39.8 70.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 74.14 110.933 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -64.21 -42.17 96.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.48 . . . . 74.54 110.885 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 22.7 tp -64.01 -51.17 65.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.871 -179.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -57.28 -50.79 71.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 74.3 110.872 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -57.92 -52.52 65.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 74.33 110.881 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.5 mt -52.75 -43.5 65.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 73.12 110.925 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -60.86 -56.6 19.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 73.52 110.858 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.09 -13.45 60.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 74.22 111.091 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.7 -57.78 3.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.217 -0.447 . . . . 72.43 110.89 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -88.41 -52.32 5.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 62.41 110.863 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.71 -12.67 61.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 74.33 110.913 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 57.04 23.33 8.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 75.43 110.915 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -69.32 179.68 1.92 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 73.24 111.119 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 3.0 m -144.09 110.94 5.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 75.53 111.13 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 39.2 t -53.64 115.59 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 75.41 111.092 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 72.1 mt -92.51 -45.7 8.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 75.22 110.955 179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.11 174.58 12.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 72.53 111.087 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 63.7 p -169.05 149.85 4.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 71.22 110.852 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -138.53 151.37 47.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 75.51 110.91 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 16.6 m -139.76 136.87 34.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 75.31 111.147 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 82.6 t -76.38 100.24 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 71.2 111.145 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 52.35 112.523 -179.999 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 N-CA-C 112.518 -0.233 . . . . 70.23 112.518 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 82.1 m -129.34 110.61 12.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.802 0.334 . . . . 73.14 111.175 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.671 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -97.38 112.19 24.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 72.52 111.138 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -101.29 118.59 37.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 71.05 110.93 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.471 HG23 ' CD2' ' A' ' 526' ' ' LEU . 1.0 OUTLIER -101.44 112.84 25.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 65.11 111.149 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.484 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -132.6 142.91 49.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.256 -0.429 . . . . 61.5 110.922 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.42 146.02 24.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 70.1 110.875 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 487' ' ' ALA . . . . . 0.726 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -151.35 167.35 28.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 61.23 111.091 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -61.04 160.48 21.11 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.623 0.725 . . . . 73.33 110.875 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -23.61 30.6 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.689 2.259 . . . . 63.35 112.317 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 32.9 m-20 -63.56 -35.06 79.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 72.31 110.916 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 46.5 t -73.81 132.94 32.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.475 . . . . 75.21 111.136 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -127.88 177.67 6.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 74.34 110.879 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 91.1 t -51.72 -42.14 30.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 72.31 111.119 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -58.54 -41.21 85.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 73.54 110.892 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 34.8 m -66.31 -44.49 83.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 74.24 111.132 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.608 ' HB3' HD13 ' A' ' 512' ' ' ILE . 7.4 mt -62.03 -51.0 69.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 75.14 110.914 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -64.32 -34.83 79.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 75.0 110.858 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -64.71 -46.38 82.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 73.41 110.89 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -70.27 -35.41 73.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 72.43 110.839 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.714 HD12 HD11 ' A' ' 512' ' ' ILE . 36.4 mt -63.61 -52.81 59.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 74.32 110.922 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.78 -37.96 79.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 71.51 110.919 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -59.32 -48.27 82.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.487 . . . . 74.11 110.902 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -66.66 -24.85 66.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 73.11 110.897 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -18.35 18.99 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.74 -0.743 . . . . 75.25 112.505 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.505 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.8 m-85 -62.21 160.25 32.95 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.657 0.741 . . . . 75.34 110.894 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 90.3 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.653 2.235 . . . . 74.22 112.335 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -107.46 -26.08 5.79 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.702 -0.761 . . . . 61.12 112.478 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -68.05 -51.94 41.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 71.15 110.891 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -75.22 -33.9 61.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 61.32 110.867 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.625 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -55.92 170.56 0.29 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 31.53 111.093 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.01 113.35 32.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.232 -0.44 . . . . 73.44 111.101 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.714 HD11 HD12 ' A' ' 500' ' ' LEU . 57.9 mt -100.05 126.74 53.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 73.3 111.128 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -125.03 148.7 48.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 74.04 111.181 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -101.25 143.63 31.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 60.31 110.878 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 90.2 t -133.07 103.62 6.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 75.43 111.133 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -68.51 99.22 0.94 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 75.24 110.916 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.573 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -76.58 160.19 77.74 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.697 . . . . 74.53 111.07 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.573 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.74 74.5 1.27 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.696 2.264 . . . . 65.24 112.369 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 4.7 t -177.68 138.88 0.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.201 -0.454 . . . . 64.12 111.157 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.73 26.14 4.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.252 -0.431 . . . . 63.12 111.087 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.86 -35.23 3.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 71.53 111.13 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -141.08 177.15 8.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 74.43 110.914 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -147.76 154.01 39.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.072 -0.513 . . . . 75.25 110.847 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -89.02 145.94 25.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 71.33 110.936 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.726 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 96.3 m-85 -129.87 124.34 32.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 72.42 110.919 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.471 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.4 OUTLIER -102.64 105.87 16.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 63.04 110.906 -179.961 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.522 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.26 125.66 49.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 70.22 111.161 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.547 ' O ' HD23 ' A' ' 529' ' ' LEU . 6.0 ttmm -104.63 107.18 18.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 74.43 110.895 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.625 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.1 mt -132.3 154.54 81.64 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 73.04 110.897 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 162.08 43.48 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.686 2.257 . . . . 71.2 112.315 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 104.36 1.31 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.669 2.246 . . . . 44.41 112.338 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.0 mt -105.32 -171.07 1.85 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 70.14 110.944 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 9.3 t -72.35 153.12 41.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 73.52 110.883 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -52.08 -44.46 64.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 70.43 110.88 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -60.48 -38.97 85.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.246 -0.434 . . . . 65.2 110.933 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -66.05 -53.22 41.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 73.4 110.856 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 -55.52 -45.54 77.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 61.14 110.868 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mt -69.06 -38.88 79.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 64.02 110.957 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -63.75 -47.03 82.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 54.03 110.908 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.505 HD22 ' CD2' ' A' ' 505' ' ' PHE . 26.1 tp -66.1 -51.14 60.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 71.3 110.945 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -58.23 -49.78 75.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 75.2 110.913 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 8.3 mmt85 -58.39 -53.5 57.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 71.22 110.881 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 10.3 mt -52.7 -43.72 65.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.215 -0.448 . . . . 64.2 110.895 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.3 -56.48 21.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 73.22 110.889 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.46 -13.31 60.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 61.14 111.115 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 22.5 t -79.51 -56.97 3.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.894 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -88.38 -52.18 5.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 72.23 110.902 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.3 tp -67.86 -12.37 60.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.161 -0.472 . . . . 74.13 110.909 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 57.63 23.38 9.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.22 -0.445 . . . . 65.32 110.852 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -65.08 179.84 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 74.2 111.114 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 19.4 m -145.13 110.94 5.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 75.42 111.142 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.4 t -59.01 108.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 72.33 111.135 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 63.8 mt -89.71 -42.23 11.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 64.53 110.898 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -158.55 175.08 14.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 75.13 111.112 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 95.2 p -171.98 145.87 1.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 71.43 110.869 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.671 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 10.6 pt-20 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.1 110.861 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.446 -0.262 . . . . 41.12 112.446 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 21.2 m -124.86 107.5 10.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.794 0.33 . . . . 62.12 111.161 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.732 ' HB3' ' CG ' ' A' ' 556' ' ' GLU . . . -94.98 114.09 25.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 52.25 111.083 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -106.1 117.38 33.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 62.2 110.965 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.474 HG23 HD22 ' A' ' 526' ' ' LEU . 0.6 OUTLIER -103.34 113.6 27.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 60.35 111.143 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.494 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.9 pt? -129.14 142.38 50.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 74.42 110.909 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -90.3 130.56 36.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 74.31 110.833 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 487' ' ' ALA . . . . . 0.659 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -133.94 169.42 17.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 74.13 111.127 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -60.49 160.55 17.88 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.652 0.739 . . . . 64.21 110.919 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -20.63 34.31 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.721 2.28 . . . . 72.01 112.302 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -67.97 -43.56 78.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 73.44 110.926 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.644 HG11 HD21 ' A' ' 548' ' ' LEU . 61.4 t -64.01 133.01 29.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.147 -0.479 . . . . 73.02 111.149 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -124.58 176.88 6.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 64.24 110.906 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 96.4 t -53.57 -50.02 52.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 75.23 111.108 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -52.05 -37.14 52.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 74.14 110.901 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 93.5 m -69.61 -41.83 75.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 64.21 111.188 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.64 ' CB ' HD13 ' A' ' 512' ' ' ILE . 8.0 mt -63.51 -49.83 72.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 75.3 110.956 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -65.87 -40.13 91.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 73.51 110.906 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -61.08 -45.48 94.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 74.52 110.878 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -69.5 -39.51 77.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 64.22 110.891 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.606 HD12 HD11 ' A' ' 512' ' ' ILE . 36.7 mt -58.86 -52.71 64.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 64.32 110.915 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -69.19 -37.96 78.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 75.44 110.873 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -56.18 -47.42 78.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 71.12 110.9 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -70.56 -22.71 62.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 71.54 110.913 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -17.86 19.43 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.739 -0.744 . . . . 53.21 112.519 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.75 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.3 m-85 -61.3 160.22 25.06 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.614 0.721 . . . . 74.33 110.883 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 93.2 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.671 2.247 . . . . 74.03 112.34 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.1 -38.12 1.28 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.699 -0.762 . . . . 64.14 112.434 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 7.9 pttt -60.53 -30.74 69.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.776 0.322 . . . . 51.2 110.906 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -95.52 -32.79 12.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.92 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.606 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -57.28 170.67 0.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 73.33 111.114 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 22.0 t -126.9 111.53 26.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 64.14 111.141 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.64 HD13 ' CB ' ' A' ' 496' ' ' LEU . 72.6 mt -100.53 137.48 27.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 65.43 111.108 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.76 138.48 39.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 74.12 111.118 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -83.96 140.48 31.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 53.21 110.893 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 67.6 t -131.82 100.38 4.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.192 -0.458 . . . . 72.3 111.125 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -67.53 112.1 4.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 54.11 110.915 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.582 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -94.51 160.26 31.99 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.619 0.723 . . . . 64.25 111.091 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.582 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.78 74.52 1.29 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.672 2.248 . . . . 72.23 112.374 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.631 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.0 t -176.43 137.48 0.28 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 62.53 111.096 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.4 25.15 4.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 61.12 111.087 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.99 -35.4 3.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 63.43 111.055 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.631 ' O ' HG23 ' A' ' 519' ' ' THR . 12.7 m-85 -143.16 170.89 14.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 71.44 110.874 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 60.5 mtt-85 -142.67 160.32 40.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 74.04 110.869 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -91.29 141.99 28.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 73.1 110.887 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.659 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 80.7 m-85 -127.86 120.31 27.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 71.34 110.867 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.474 HD22 HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -96.39 106.22 18.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 70.53 110.935 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.546 ' CG1' HD21 ' A' ' 529' ' ' LEU . 20.0 t -100.93 118.07 47.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 64.51 111.129 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.524 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 0.5 OUTLIER -96.6 107.45 19.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 74.25 110.91 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.606 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.3 mt -130.33 154.38 81.47 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.563 0.696 . . . . 61.52 110.93 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 162.15 43.2 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.675 2.25 . . . . 72.04 112.327 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 117.19 4.94 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.695 2.264 . . . . 61.25 112.299 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 2.5 mt -118.83 -170.96 2.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 74.23 110.91 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.1 t -67.23 148.16 52.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 74.2 110.844 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -51.91 -48.02 64.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 71.01 110.85 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -61.95 -44.53 96.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 62.53 110.86 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -61.07 -54.04 49.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.483 . . . . 73.12 110.903 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -54.14 -53.05 58.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.253 -0.431 . . . . 54.52 110.838 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -60.42 -40.0 89.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 70.33 110.902 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -63.25 -48.82 76.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 71.12 110.88 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.75 HD22 ' CD2' ' A' ' 505' ' ' PHE . 49.1 tp -59.01 -51.04 71.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 62.31 110.937 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -56.37 -48.81 76.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 74.34 110.892 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -63.82 -37.93 89.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 72.12 110.833 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 4.8 tt -60.27 -50.95 71.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 74.41 110.921 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 544' ' ' PHE . . . . . 0.508 ' CE2' HD11 ' A' ' 540' ' ' LEU . 12.2 m-85 -63.35 -50.56 69.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 72.34 110.837 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.504 ' HA ' ' HB3' ' A' ' 550' ' ' ALA . . . -61.12 -27.49 68.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 70.04 111.066 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.7 t -80.71 -62.73 1.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.253 -0.431 . . . . 64.41 110.818 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -64.62 -59.44 4.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 54.41 110.88 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.644 HD21 HG11 ' A' ' 491' ' ' VAL . 1.7 tp -68.93 -8.58 45.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.138 -0.483 . . . . 74.1 110.941 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.71 22.56 11.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 75.42 110.901 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 550' ' ' ALA . . . . . 0.504 ' HB3' ' HA ' ' A' ' 545' ' ' ALA . . . -73.84 179.6 4.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 50.31 111.091 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.5 m -145.05 110.95 5.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 55.53 111.101 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 46.9 t -52.11 112.48 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 53.42 111.131 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 13.4 mt -88.58 -51.95 5.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.149 -0.478 . . . . 42.34 110.932 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.55 173.78 15.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 75.33 111.047 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 95.2 p -160.7 145.41 14.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 63.41 110.84 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.732 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 9.4 pt-20 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.124 -0.489 . . . . 51.31 110.911 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 N-CA-C 112.461 -0.255 . . . . 51.01 112.461 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 20.1 m -128.91 109.35 11.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.751 0.31 . . . . 74.41 111.139 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -96.0 123.98 39.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 64.0 111.111 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -115.05 111.29 20.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.213 -0.449 . . . . 75.55 110.921 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.81 113.97 25.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.109 -0.496 . . . . 45.13 111.138 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.507 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.9 pt? -130.28 143.09 50.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 60.34 110.924 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.603 ' HB2' HD21 ' A' ' 553' ' ' LEU . 10.8 ttt180 -86.99 141.38 28.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 72.0 110.885 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 487' ' ' ALA . . . . . 0.738 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -149.47 160.64 43.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 64.34 111.137 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 488' ' ' GLU . . . . . 0.643 ' HG2' HG23 ' A' ' 491' ' ' VAL . 1.6 pm0 -51.72 156.85 2.16 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.658 0.742 . . . . 75.33 110.894 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 -9.24 25.63 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.712 2.275 . . . . 74.22 112.375 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -77.87 -44.66 26.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 71.5 110.918 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.643 HG23 ' HG2' ' A' ' 488' ' ' GLU . 97.4 t -56.34 124.29 9.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 74.52 111.153 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -116.67 171.41 7.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 70.24 110.898 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 91.5 t -51.71 -49.52 34.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 72.43 111.101 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -53.02 -40.17 63.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 72.43 110.932 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 89.5 m -66.91 -45.43 77.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 71.44 111.182 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.485 ' CB ' HD13 ' A' ' 512' ' ' ILE . 8.7 mt -61.58 -51.08 70.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.205 -0.452 . . . . 63.23 110.923 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 497' ' ' ARG . . . . . 0.488 ' HB3' HD12 ' A' ' 512' ' ' ILE . 9.4 ptm180 -63.5 -37.0 85.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 63.35 110.863 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 29.5 mtt85 -63.75 -44.29 93.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 73.25 110.895 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -70.25 -36.62 74.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 75.4 110.895 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.525 HD12 HD11 ' A' ' 512' ' ' ILE . 38.4 mt -63.04 -53.05 59.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 61.54 110.92 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -67.97 -38.36 82.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 72.3 110.88 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -58.52 -48.56 80.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.3 110.914 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -65.89 -25.07 67.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 71.42 110.896 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.04 -17.88 19.38 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.754 -0.736 . . . . 43.31 112.464 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.793 ' CD2' HD22 ' A' ' 540' ' ' LEU . 18.4 m-85 -62.18 160.21 32.96 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.65 0.738 . . . . 71.43 110.891 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 506' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 53.5 Cg_endo -69.75 88.29 0.54 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.691 2.261 . . . . 62.25 112.337 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -104.64 -28.36 5.71 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.783 -0.722 . . . . 55.11 112.513 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt -64.91 -52.02 58.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.744 0.307 . . . . 74.3 110.949 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -75.76 -26.11 57.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 63.51 110.868 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.611 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -63.55 167.32 5.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 52.3 111.084 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.92 112.83 30.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 62.3 111.108 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.525 HD11 HD12 ' A' ' 500' ' ' LEU . 43.6 mt -97.67 129.35 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 73.35 111.106 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -123.01 142.67 50.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 53.1 111.088 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -98.64 129.43 45.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 55.32 110.915 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 84.7 t -122.88 102.69 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.257 -0.429 . . . . 73.54 111.151 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.17 109.13 10.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.45 . . . . 64.41 110.935 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -88.46 160.31 45.25 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.584 0.707 . . . . 74.3 111.081 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.3 Cg_endo -69.76 74.48 1.29 Allowed 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.752 2.301 . . . . 75.13 112.315 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.503 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.6 t -176.54 137.02 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 64.31 111.154 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.68 28.64 2.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.435 . . . . 53.21 111.106 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.22 -34.74 3.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 54.42 111.088 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.503 ' O ' HG23 ' A' ' 519' ' ' THR . 13.8 m-85 -149.18 169.9 19.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 72.55 110.969 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 44.9 mtp180 -143.63 162.3 36.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 63.22 110.853 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -96.1 141.24 29.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 71.53 110.883 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.738 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 89.5 m-85 -128.54 124.31 35.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 71.5 110.878 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 526' ' ' LEU . 0.5 OUTLIER -99.53 110.01 22.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 72.15 110.943 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.536 HG12 HD21 ' A' ' 529' ' ' LEU . 21.5 t -101.71 116.73 45.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.459 . . . . 75.53 111.107 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.544 ' O ' HD23 ' A' ' 529' ' ' LEU . 26.1 tttt -96.5 108.25 20.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 71.02 110.881 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.611 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.5 mt -132.7 154.45 81.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.611 0.72 . . . . 75.53 110.903 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 162.09 43.43 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.726 2.284 . . . . 74.3 112.327 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 112.93 3.21 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.697 2.264 . . . . 63.44 112.302 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.5 mt -114.89 -172.68 2.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 62.32 110.921 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 31.6 m -64.32 149.34 48.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 62.11 110.88 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.94 -50.83 60.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.144 -0.48 . . . . 72.33 110.871 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -62.54 -37.19 85.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 74.23 110.853 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -64.49 -53.88 41.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.865 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -57.9 -51.11 70.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 74.52 110.82 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.7 -41.07 94.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.224 -0.444 . . . . 71.23 110.943 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -61.91 -47.36 85.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 64.35 110.884 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.793 HD22 ' CD2' ' A' ' 505' ' ' PHE . 29.6 tp -61.24 -51.1 70.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.188 -0.46 . . . . 71.23 110.961 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -55.52 -45.26 77.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 74.23 110.912 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 11.8 mtp85 -68.15 -38.68 82.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 71.51 110.902 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 543' ' ' LEU . . . . . 0.533 ' O ' HD23 ' A' ' 543' ' ' LEU . 4.9 tt -60.52 -41.94 95.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 44.32 110.93 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 544' ' ' PHE . . . . . 0.504 ' CE2' HD11 ' A' ' 540' ' ' LEU . 9.8 m-85 -72.16 -50.64 26.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 71.21 110.832 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 545' ' ' ALA . . . . . 0.471 ' HA ' ' HB3' ' A' ' 550' ' ' ALA . . . -61.47 -26.36 67.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 60.51 111.142 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 67.5 p -80.72 -62.67 1.6 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 71.34 110.908 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -65.98 -58.95 4.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.113 -0.494 . . . . 74.21 110.891 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.508 HD21 HG11 ' A' ' 491' ' ' VAL . 1.8 tp -68.92 -8.53 45.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.158 -0.473 . . . . 65.32 110.93 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt 64.61 22.84 12.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 62.43 110.883 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 550' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' A' ' 545' ' ' ALA . . . -72.32 178.46 3.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 65.1 111.077 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 63.3 m -145.03 110.91 5.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 72.21 111.111 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.2 t -52.15 123.63 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 74.15 111.156 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 553' ' ' LEU . . . . . 0.603 HD21 ' HB2' ' A' ' 486' ' ' ARG . 18.4 mt -103.78 -49.64 3.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 73.3 110.942 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -151.26 172.67 15.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 63.44 111.082 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 89.3 p -163.35 155.23 17.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 61.41 110.886 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 71.44 110.913 -179.959 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.518 -0.233 . . . . 63.11 112.518 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 34.0 m -131.5 110.71 11.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.76 0.314 . . . . 75.02 111.117 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.48 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -96.59 119.73 35.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 60.14 111.147 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -110.43 113.77 26.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.995 0.426 . . . . 65.15 110.916 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.495 HG23 HD22 ' A' ' 526' ' ' LEU . 1.3 m -97.89 112.31 24.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.099 -0.501 . . . . 74.24 111.098 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.453 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.7 pt? -134.19 142.39 47.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 73.24 110.917 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -88.85 141.5 28.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 72.13 110.892 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 487' ' ' ALA . . . . . 0.697 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -140.4 160.95 38.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 72.33 111.102 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 488' ' ' GLU . . . . . 0.63 ' HG3' HG23 ' A' ' 491' ' ' VAL . 7.0 pt-20 -51.76 156.9 2.16 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.613 0.721 . . . . 74.11 110.89 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -9.14 25.37 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.686 2.257 . . . . 64.21 112.326 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -80.7 -43.08 20.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 73.22 110.82 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.63 HG23 ' HG3' ' A' ' 488' ' ' GLU . 72.1 t -65.69 134.19 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 75.01 111.116 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -125.81 175.88 7.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 61.11 110.903 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 60.6 t -51.65 -49.91 32.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 74.22 111.113 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -51.93 -41.46 62.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 63.21 110.899 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 88.4 m -67.91 -37.96 82.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.113 -0.494 . . . . 74.14 111.147 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.624 ' HB3' HD13 ' A' ' 512' ' ' ILE . 3.9 mt -64.94 -50.95 64.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 63.12 110.942 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 17.9 ptt85 -63.86 -42.94 97.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 62.31 110.855 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -61.66 -41.73 97.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.447 . . . . 73.42 110.862 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -69.46 -40.39 77.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 53.02 110.906 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.92 -51.77 67.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 72.54 110.936 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.87 -38.34 82.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 73.42 110.895 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -57.92 -48.84 78.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 61.21 110.901 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -67.67 -24.9 65.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 74.32 110.866 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -18.46 18.92 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.704 -0.76 . . . . 71.21 112.48 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.427 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.5 m-85 -65.35 160.27 59.96 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.705 0.765 . . . . 75.41 110.838 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 95.6 0.56 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.682 2.255 . . . . 64.25 112.334 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -112.3 -51.97 0.53 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.717 -0.754 . . . . 63.54 112.454 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -52.04 -51.56 56.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.713 0.292 . . . . 72.43 110.86 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -27.39 65.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 74.12 110.846 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.599 ' HB1' ' O ' ' A' ' 528' ' ' LYS . . . -68.61 175.26 3.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 74.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.02 111.11 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.466 . . . . 71.32 111.151 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.624 HD13 ' HB3' ' A' ' 496' ' ' LEU . 69.5 mt -97.45 140.92 16.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 75.41 111.119 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.5 m -136.16 147.46 47.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 62.33 111.175 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -98.72 143.62 28.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.221 -0.445 . . . . 74.13 110.933 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 60.0 t -139.0 111.01 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.182 -0.463 . . . . 72.53 111.122 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.66 113.42 15.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 75.3 110.897 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.589 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -95.06 160.27 31.25 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.571 0.7 . . . . 73.54 111.099 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.589 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.4 Cg_endo -69.74 74.56 1.27 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.707 2.271 . . . . 63.34 112.316 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.583 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.9 t -176.59 139.24 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 62.44 111.093 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.5 27.27 4.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 72.21 111.098 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.5 -34.94 3.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 53.32 111.12 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.583 ' O ' HG23 ' A' ' 519' ' ' THR . 12.5 m-85 -146.03 162.63 37.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.241 -0.436 . . . . 74.14 110.945 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 71.3 mtt-85 -130.37 160.93 32.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.095 -0.502 . . . . 72.02 110.904 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 63.7 tt0 -94.23 139.76 30.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 63.12 110.905 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.697 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 89.6 m-85 -127.85 124.64 38.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 74.52 110.905 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.495 HD22 HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -101.09 103.58 14.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.164 -0.471 . . . . 64.31 110.966 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.548 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.5 t -96.82 127.94 48.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 73.23 111.142 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.599 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 41.6 tttt -106.91 109.0 20.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 75.55 110.871 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.594 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.5 mt -130.6 154.39 81.7 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.587 0.708 . . . . 74.55 110.921 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 162.14 43.2 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.654 2.236 . . . . 72.24 112.31 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 109.63 2.37 Favored 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.697 2.264 . . . . 74.52 112.31 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.7 mt -111.54 -172.35 2.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 75.5 110.943 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.66 153.67 42.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 63.3 110.827 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -52.1 -46.35 65.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 74.25 110.826 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -60.34 -36.0 76.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 74.22 110.877 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -66.36 -56.62 10.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 74.11 110.861 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 -54.93 -44.84 74.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.461 . . . . 74.14 110.878 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.51 HD22 ' NE ' ' A' ' 542' ' ' ARG . 2.3 mt -67.9 -41.04 83.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 74.05 110.92 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.17 -46.83 85.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.21 -0.45 . . . . 75.53 110.919 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.427 HD22 ' CD2' ' A' ' 505' ' ' PHE . 23.9 tp -64.95 -51.15 63.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 71.42 110.931 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -58.47 -50.25 74.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 75.22 110.902 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 542' ' ' ARG . . . . . 0.51 ' NE ' HD22 ' A' ' 538' ' ' LEU . 96.8 mtt180 -58.45 -53.25 60.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 62.42 110.878 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 543' ' ' LEU . . . . . 0.48 ' O ' HD23 ' A' ' 543' ' ' LEU . 5.7 tt -52.76 -43.48 65.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.897 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -60.68 -56.47 20.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.456 . . . . 74.15 110.915 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.32 -13.34 60.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 75.3 111.121 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.65 -57.27 3.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 63.31 110.85 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -88.36 -52.29 5.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 70.34 110.831 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.77 -12.37 60.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 72.21 110.916 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp 57.25 23.53 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 74.45 110.924 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.36 174.21 2.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 54.34 111.079 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 92.4 m -135.49 110.96 9.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.215 -0.448 . . . . 61.5 111.114 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.7 t -58.22 108.34 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 44.13 111.133 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 10.3 mt -84.49 -49.2 8.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 74.54 110.963 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -159.03 173.8 15.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.468 . . . . 73.23 111.144 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 93.8 p -165.57 139.32 4.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 62.42 110.848 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.48 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 1.2 pm0 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 72.2 110.877 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 N-CA-C 112.487 -0.245 . . . . 71.25 112.487 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 2.7 m -125.29 107.51 10.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.743 0.306 . . . . 51.53 111.128 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.0 116.58 28.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 52.41 111.107 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -105.95 114.21 28.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 74.21 110.909 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.493 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.9 OUTLIER -98.54 113.89 26.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 74.22 111.108 -179.976 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.492 ' H ' HD23 ' A' ' 485' ' ' LEU . 2.0 pt? -133.15 147.02 52.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 72.4 110.943 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.92 147.12 23.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 74.31 110.855 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 487' ' ' ALA . . . . . 0.679 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -156.73 165.81 35.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 75.54 111.069 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -53.64 153.52 7.83 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.65 0.738 . . . . 61.13 110.9 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.7 -12.32 32.77 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.692 2.261 . . . . 74.43 112.326 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -74.24 -38.34 63.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 71.22 110.886 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 93.6 t -65.85 124.47 20.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 71.43 111.114 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -114.97 174.65 5.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 73.22 110.894 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.447 HG13 ' HB ' ' A' ' 512' ' ' ILE . 96.2 t -52.05 -45.77 41.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.173 -0.467 . . . . 65.33 111.151 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -54.42 -40.22 68.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 61.44 110.909 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 85.5 m -67.04 -44.17 80.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 73.12 111.179 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.547 ' CB ' HD13 ' A' ' 512' ' ' ILE . 5.1 mt -62.22 -51.04 69.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.435 . . . . 74.53 110.911 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 497' ' ' ARG . . . . . 0.447 ' HB3' HD12 ' A' ' 512' ' ' ILE . 26.5 ptt180 -64.35 -35.95 82.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 75.34 110.869 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -63.92 -46.05 86.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 74.23 110.894 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -69.99 -36.11 74.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 75.22 110.925 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.603 HD12 HD11 ' A' ' 512' ' ' ILE . 35.7 mt -62.66 -52.78 61.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 72.04 110.912 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -68.62 -38.04 80.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 75.33 110.925 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -58.7 -48.02 82.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 72.15 110.878 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -67.38 -24.33 65.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 75.13 110.908 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.01 -18.86 18.6 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.738 -0.744 . . . . 70.15 112.513 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.671 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.1 m-85 -62.57 160.3 35.77 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.673 0.749 . . . . 71.43 110.896 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 93.18 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.747 2.298 . . . . 72.24 112.348 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -106.96 -41.03 1.74 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.733 -0.746 . . . . 73.52 112.513 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -58.75 -51.67 68.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.755 0.312 . . . . 75.54 110.94 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -31.19 67.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.439 . . . . 70.43 110.932 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.635 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -63.64 169.91 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 54.14 111.065 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.96 111.27 25.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 72.24 111.151 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.603 HD11 HD12 ' A' ' 500' ' ' LEU . 73.4 mt -96.87 136.35 27.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.2 -0.455 . . . . 72.02 111.131 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.6 m -137.44 140.58 41.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 73.34 111.109 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -91.98 143.0 26.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.443 . . . . 72.43 110.885 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 99.0 t -133.74 125.65 49.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 64.42 111.143 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -79.97 126.29 30.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 54.24 110.951 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.586 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -109.53 160.2 28.69 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.564 0.697 . . . . 71.31 111.112 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.586 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.6 Cg_endo -69.81 74.6 1.3 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.637 2.224 . . . . 72.45 112.35 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.504 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.9 t -179.91 137.11 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 54.11 111.123 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.6 24.49 5.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 74.4 111.114 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.03 -35.31 3.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 44.31 111.106 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.504 ' O ' HG23 ' A' ' 519' ' ' THR . 7.7 m-85 -135.38 167.22 21.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 63.25 110.914 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 7.8 mmm-85 -137.26 162.2 34.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 71.41 110.886 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -95.47 144.84 25.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 74.02 110.909 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.679 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 92.6 m-85 -131.52 122.29 25.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.45 110.898 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.493 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.4 OUTLIER -103.11 103.57 13.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 73.03 110.899 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.533 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.5 t -96.59 128.36 47.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 74.51 111.142 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.538 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 38.4 tttm -104.65 108.55 20.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 64.44 110.873 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.635 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.9 mt -130.92 154.36 81.95 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.624 0.726 . . . . 61.54 110.924 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 162.09 43.41 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.697 2.265 . . . . 73.33 112.338 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.73 105.21 1.44 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.67 2.247 . . . . 75.52 112.321 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -105.04 -171.1 1.86 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 63.05 110.943 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 43.2 t -73.53 151.04 41.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 73.24 110.847 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -52.0 -50.02 62.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 64.34 110.912 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.3 -49.26 77.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.166 -0.47 . . . . 70.0 110.893 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 14.9 mmp_? -56.45 -56.78 16.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.162 -0.472 . . . . 61.53 110.902 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 26.1 mtp180 -53.35 -46.51 69.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 72.33 110.863 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.1 mt -61.44 -37.67 84.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.446 . . . . 72.43 110.945 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -66.3 -44.28 83.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.172 -0.467 . . . . 74.21 110.897 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.671 HD22 ' CD2' ' A' ' 505' ' ' PHE . 21.5 tp -63.04 -51.16 67.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 75.34 110.96 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -58.47 -49.55 76.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.457 . . . . 70.13 110.873 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 60.8 mtt-85 -58.48 -53.03 62.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 73.33 110.876 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 543' ' ' LEU . . . . . 0.462 ' O ' HD23 ' A' ' 543' ' ' LEU . 5.0 tt -52.71 -44.8 66.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 74.33 110.917 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -59.67 -56.39 22.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 63.15 110.871 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.3 -13.29 60.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 31.12 111.092 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 16.8 t -79.51 -57.26 3.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 74.42 110.849 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -88.37 -52.16 5.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 73.44 110.89 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.447 HD23 ' HB2' ' A' ' 550' ' ' ALA . 1.3 tp -67.83 -12.47 60.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 75.42 110.927 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 32.9 mmtm 57.62 23.11 8.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 75.54 110.87 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 550' ' ' ALA . . . . . 0.447 ' HB2' HD23 ' A' ' 548' ' ' LEU . . . -66.18 -179.66 0.8 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 34.54 111.09 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 27.8 m -141.71 110.94 6.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 72.12 111.191 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.12 107.61 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 74.35 111.137 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 11.7 mt -83.28 -49.92 8.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 75.32 110.942 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.46 174.92 11.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 72.34 111.057 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 82.7 p -156.98 154.91 30.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 74.54 110.848 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.11 -0.496 . . . . 55.41 110.895 -179.917 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.248 0 N-CA-C 112.455 -0.258 . . . . 73.23 112.455 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 16.0 m -126.77 109.01 11.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.811 0.339 . . . . 75.42 111.153 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.688 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -95.53 130.14 42.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 72.33 111.08 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -119.34 113.6 21.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.203 -0.453 . . . . 65.44 110.953 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.464 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.9 OUTLIER -96.78 110.98 23.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 64.3 111.126 -179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.489 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -132.51 143.51 49.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 72.11 110.957 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -91.05 142.82 27.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 73.42 110.878 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 487' ' ' ALA . . . . . 0.519 ' HB3' ' CE1' ' A' ' 525' ' ' PHE . . . -144.58 170.9 15.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 71.24 111.103 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.28 160.54 40.06 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.607 0.718 . . . . 73.14 110.908 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 -14.53 36.25 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.683 2.255 . . . . 72.32 112.334 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -73.22 -44.99 58.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 61.31 110.849 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.541 HG11 HD21 ' A' ' 548' ' ' LEU . 98.5 t -64.06 138.45 23.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 71.51 111.13 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -136.27 178.98 6.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 71.43 110.882 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.463 HG13 ' HB ' ' A' ' 512' ' ' ILE . 48.5 t -51.74 -48.63 37.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 60.54 111.121 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 60.7 tt0 -51.7 -39.91 59.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 65.12 110.852 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.0 m -71.55 -35.42 70.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 72.51 111.195 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.598 ' CB ' HD13 ' A' ' 512' ' ' ILE . 4.9 mt -67.38 -44.71 78.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 73.25 110.888 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -69.97 -46.03 66.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 71.31 110.876 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.8 ptm180 -64.61 -32.7 74.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 53.33 110.895 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -73.8 -45.11 53.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 71.1 110.867 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.412 HD23 HD11 ' A' ' 540' ' ' LEU . 50.3 mt -62.58 -42.45 99.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 74.23 110.92 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.17 -37.79 66.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 73.35 110.896 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -61.45 -47.47 85.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 73.5 110.882 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -69.14 -24.29 64.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.913 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.05 -16.75 20.24 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.77 -0.729 . . . . 54.43 112.453 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.411 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.6 m-85 -68.07 160.25 75.58 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.646 0.736 . . . . 72.23 110.834 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 97.25 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.649 2.233 . . . . 61.44 112.363 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -109.83 -44.9 1.0 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.734 -0.746 . . . . 74.43 112.513 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -60.2 -52.0 67.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.757 0.313 . . . . 74.15 110.946 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -66.71 -33.4 75.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 74.55 110.907 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.622 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -63.78 175.4 1.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 71.01 111.096 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -127.04 116.35 44.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 74.21 111.137 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.598 HD13 ' CB ' ' A' ' 496' ' ' LEU . 64.1 mt -96.2 143.0 12.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 73.34 111.114 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.94 135.55 32.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.472 . . . . 73.34 111.167 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -94.89 143.98 26.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 72.31 110.888 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 82.7 t -138.62 106.16 3.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 61.53 111.17 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -72.79 101.38 3.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 65.12 110.907 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.564 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -79.96 160.23 69.22 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.589 0.709 . . . . 33.32 111.105 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.564 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.3 Cg_endo -69.71 74.54 1.26 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.703 2.269 . . . . 74.23 112.377 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.602 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.9 t -176.38 139.56 0.35 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 71.22 111.162 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -97.35 26.01 5.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 72.31 111.144 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.63 -35.06 3.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 74.42 111.143 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.602 ' O ' HG23 ' A' ' 519' ' ' THR . 16.6 m-85 -144.12 165.22 28.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.474 . . . . 74.03 110.915 -179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 26.7 mtt-85 -134.57 156.98 47.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.085 -0.507 . . . . 73.41 110.844 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -89.47 135.54 33.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.885 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.519 ' CE1' ' HB3' ' A' ' 487' ' ' ALA . 85.2 m-85 -123.62 123.54 40.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 62.22 110.892 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.464 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -103.61 107.95 19.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.171 -0.468 . . . . 65.12 110.928 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.554 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.4 t -100.57 121.59 51.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.449 . . . . 52.04 111.098 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.607 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 12.8 tttm -99.86 109.27 21.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 64.54 110.933 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.622 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.9 mt -131.24 154.26 81.91 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.596 0.712 . . . . 75.53 110.95 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 162.14 43.22 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.731 2.287 . . . . 72.31 112.329 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.86 109.62 2.38 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.622 2.215 . . . . 64.42 112.32 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.5 mt -111.32 -171.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 71.01 110.941 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 7.3 t -71.02 171.09 11.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 54.02 110.86 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -66.91 -48.18 69.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 74.03 110.873 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -59.07 -34.65 72.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 72.55 110.879 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 23.7 mmt180 -66.32 -55.76 14.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.455 . . . . 75.21 110.889 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -56.32 -43.27 78.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 75.14 110.868 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.3 mt -67.66 -39.35 84.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 75.52 110.938 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -66.31 -48.29 70.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 72.53 110.878 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.412 HD11 HD23 ' A' ' 500' ' ' LEU . 21.4 tp -62.02 -51.11 69.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 65.41 110.943 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -58.37 -51.22 70.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 72.2 110.883 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -57.96 -52.64 64.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 74.12 110.874 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 11.0 mt -52.85 -43.64 66.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 75.41 110.87 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -60.63 -56.52 20.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.438 . . . . 74.51 110.89 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.32 -13.29 60.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 70.32 111.09 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.61 -57.51 3.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.436 . . . . 74.34 110.812 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -88.38 -52.22 5.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 74.02 110.883 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.541 HD21 HG11 ' A' ' 491' ' ' VAL . 2.0 tp -67.84 -12.42 60.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 64.1 110.883 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.13 23.47 8.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 72.14 110.919 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.51 178.5 1.59 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 64.51 111.07 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 24.4 m -145.08 110.99 5.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 73.04 111.124 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 61.0 t -54.22 124.8 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 54.32 111.113 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 41.2 mt -108.2 -47.32 3.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 73.41 110.921 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -151.94 174.06 14.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 51.33 111.105 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 91.2 p -172.23 148.75 2.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.259 -0.428 . . . . 44.31 110.852 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.688 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 22.1 pt-20 . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.485 . . . . 74.14 110.855 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.493 -0.243 . . . . 74.24 112.493 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 29.8 m -131.36 112.95 13.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.351 . . . . 73.21 111.135 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.775 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -95.02 127.68 41.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 52.04 111.121 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -116.4 109.84 17.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.451 . . . . 72.34 110.907 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.585 HG23 HD23 ' A' ' 526' ' ' LEU . 0.5 OUTLIER -94.05 114.63 26.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 65.11 111.119 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.454 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -137.33 143.56 42.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 61.22 110.927 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.753 ' HB2' HD11 ' A' ' 553' ' ' LEU . 19.6 ttm180 -95.86 143.15 27.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 72.22 110.865 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -145.77 171.03 15.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 74.42 111.1 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -61.28 160.66 21.95 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.673 0.749 . . . . 74.53 110.87 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -15.36 37.0 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.66 2.24 . . . . 71.11 112.357 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -69.73 -46.72 65.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 71.31 110.881 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 41.0 t -68.81 127.79 31.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 72.45 111.177 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -123.05 178.77 4.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.449 . . . . 74.15 110.931 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 59.1 t -51.65 -47.77 37.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 74.0 111.133 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -51.77 -40.18 59.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 54.21 110.923 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.1 m -71.12 -35.36 71.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 74.34 111.14 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.579 ' CB ' HD13 ' A' ' 512' ' ' ILE . 3.6 mt -67.3 -45.65 75.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 75.41 110.924 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -68.87 -46.13 69.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 74.43 110.865 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -64.86 -32.28 73.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 72.04 110.822 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -73.42 -44.6 57.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 73.24 110.92 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.74 -41.99 97.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.137 -0.483 . . . . 75.24 110.96 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -73.09 -37.71 66.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 73.13 110.949 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.32 -48.2 80.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.104 -0.498 . . . . 74.22 110.842 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -67.78 -24.44 65.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 73.01 110.858 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -15.93 20.75 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.756 -0.735 . . . . 64.54 112.505 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.505 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.6 m-85 -64.7 160.27 54.88 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.681 0.753 . . . . 72.02 110.853 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 91.09 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.698 2.266 . . . . 72.34 112.359 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -106.93 -28.16 5.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.717 -0.754 . . . . 61.04 112.518 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -64.38 -51.85 61.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.778 0.323 . . . . 73.54 110.92 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -75.66 -34.38 60.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 70.31 110.883 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.559 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -52.85 165.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 61.23 111.1 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.04 110.95 24.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 72.14 111.112 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.579 HD13 ' CB ' ' A' ' 496' ' ' LEU . 61.1 mt -90.66 142.99 12.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 72.32 111.158 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.59 133.26 47.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 63.23 111.147 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 514' ' ' GLN . . . . . 0.409 HE21 ' N ' ' A' ' 515' ' ' VAL . 26.6 tp60 -97.35 118.54 34.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.14 110.936 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 515' ' ' VAL . . . . . 0.409 ' N ' HE21 ' A' ' 514' ' ' GLN . 98.1 t -123.32 97.69 4.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.251 -0.431 . . . . 43.31 111.184 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -74.87 99.06 3.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.43 110.908 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.592 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -66.98 160.32 70.83 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.567 0.699 . . . . 65.33 111.133 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.592 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.78 74.41 1.3 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.707 2.271 . . . . 62.34 112.354 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.9 t 179.1 140.21 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.231 -0.44 . . . . 74.24 111.097 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.41 33.24 1.62 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 71.11 111.111 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.63 -33.94 3.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 72.15 111.122 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -147.74 176.97 9.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 65.33 110.918 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -148.06 149.12 31.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 63.04 110.891 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -91.9 138.84 31.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 72.54 110.938 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -130.64 133.77 46.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 72.44 110.936 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.585 HD23 HG23 ' A' ' 484' ' ' THR . 0.6 OUTLIER -109.44 106.08 15.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 73.23 110.889 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.652 HG12 HD21 ' A' ' 529' ' ' LEU . 21.2 t -96.02 112.27 27.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 60.5 111.139 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.502 ' O ' HD23 ' A' ' 529' ' ' LEU . 35.3 tttp -90.47 112.11 23.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 73.31 110.913 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.652 HD21 HG12 ' A' ' 527' ' ' VAL . 6.5 mt -132.67 154.28 81.42 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.592 0.711 . . . . 72.11 110.895 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 162.2 42.99 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.67 2.247 . . . . 71.12 112.342 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 107.46 1.86 Allowed 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.665 2.244 . . . . 73.41 112.361 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -109.12 -170.99 1.76 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.195 -0.457 . . . . 71.35 110.958 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 7.8 p -72.74 152.05 41.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 74.52 110.89 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -51.94 -41.18 61.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.154 -0.475 . . . . 70.13 110.864 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -62.09 -43.93 97.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 62.15 110.858 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? -64.64 -48.48 74.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 74.32 110.903 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -56.41 -52.98 62.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 73.23 110.858 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -64.34 -40.51 96.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 74.34 110.925 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.46 -46.17 91.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 55.15 110.848 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.505 HD22 ' CD2' ' A' ' 505' ' ' PHE . 24.0 tp -64.01 -51.06 65.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 44.12 110.863 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -57.78 -50.12 74.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 72.54 110.871 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -57.94 -53.44 58.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 63.35 110.899 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 543' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 543' ' ' LEU . 3.0 tt -52.63 -43.37 65.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 64.45 110.922 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -60.63 -56.53 20.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.21 110.894 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.43 -13.3 60.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 52.11 111.063 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.59 -57.3 3.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 73.03 110.882 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -88.36 -52.24 5.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.14 -0.482 . . . . 73.41 110.914 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.86 -12.42 60.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.54 110.933 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt 57.45 23.27 8.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.168 -0.469 . . . . 74.34 110.901 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.26 -179.05 0.92 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 73.43 111.075 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 89.8 m -145.01 110.95 5.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 70.13 111.171 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 31.7 t -55.62 108.53 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 72.3 111.149 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 553' ' ' LEU . . . . . 0.753 HD11 ' HB2' ' A' ' 486' ' ' ARG . 27.2 mt -85.43 -43.19 13.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 73.52 110.925 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -166.54 174.54 8.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 64.31 111.059 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 75.7 m -161.38 148.93 15.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.454 . . . . 73.23 110.845 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.775 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 24.9 pt-20 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 71.4 110.874 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 112.507 -0.237 . . . . 73.04 112.507 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 61.3 m -125.13 114.15 18.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 71.41 111.129 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.769 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -98.87 138.71 35.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 71.41 111.085 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -123.89 112.13 16.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 74.43 110.916 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.8 m -93.89 110.14 21.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 73.14 111.112 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.481 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.7 pt? -132.57 145.35 51.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 73.2 110.938 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 23.5 ttp180 -100.0 129.01 46.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 75.42 110.866 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -131.83 170.97 14.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 63.21 111.083 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -58.19 160.26 9.49 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.643 0.735 . . . . 62.33 110.86 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -15.66 37.17 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.724 2.282 . . . . 74.01 112.324 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -71.7 -45.56 61.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 64.1 110.93 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.532 HG11 HD21 ' A' ' 548' ' ' LEU . 99.2 t -61.42 121.11 8.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 63.33 111.123 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -117.07 173.79 6.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.913 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.5 t -51.56 -48.5 35.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 51.44 111.111 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -52.44 -39.81 61.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 52.34 110.896 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.3 m -71.2 -35.58 71.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 65.35 111.151 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.759 ' HB3' HD13 ' A' ' 512' ' ' ILE . 2.8 mt -67.36 -45.58 75.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 74.24 110.908 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.6 ptt85 -69.0 -46.05 69.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 72.34 110.892 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -64.86 -32.12 73.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 74.41 110.82 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -73.36 -45.64 53.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.222 -0.445 . . . . 74.34 110.861 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 49.2 mt -62.86 -42.1 99.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 73.14 110.891 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -73.06 -37.65 66.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.431 . . . . 73.21 110.902 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -61.38 -48.92 79.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 72.45 110.955 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -67.51 -22.78 65.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.491 . . . . 61.05 110.907 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -18.43 18.95 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.739 -0.743 . . . . 74.11 112.474 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.493 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.4 m-85 -66.08 160.3 64.74 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.664 0.745 . . . . 74.12 110.876 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 101.93 0.97 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.71 2.273 . . . . 70.55 112.319 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -120.72 -30.55 1.36 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.731 -0.747 . . . . 75.33 112.472 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.2 -42.28 65.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.707 0.289 . . . . 71.31 110.882 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -80.46 -36.83 32.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 73.41 110.898 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.627 ' HB1' ' O ' ' A' ' 528' ' ' LYS . . . -59.21 177.46 0.17 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.159 -0.473 . . . . 72.24 111.068 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.0 112.52 29.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 73.52 111.123 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.759 HD13 ' HB3' ' A' ' 496' ' ' LEU . 47.3 mt -96.16 128.06 47.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 54.21 111.12 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.98 147.21 46.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 61.45 111.122 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.5 tm0? -103.61 144.02 31.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 74.31 110.927 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 94.5 t -136.57 108.73 7.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 71.32 111.127 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.01 109.72 15.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 74.15 110.951 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.589 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -89.44 160.32 42.39 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.561 0.696 . . . . 71.1 111.139 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.589 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.8 Cg_endo -69.75 74.44 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.696 2.264 . . . . 73.24 112.35 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t 179.27 136.54 0.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 75.2 111.127 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -96.46 32.32 2.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 43.21 111.07 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.97 -34.16 3.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 44.55 111.092 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -150.81 145.67 25.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.208 -0.451 . . . . 74.34 110.944 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -115.98 154.39 29.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.117 -0.492 . . . . 74.43 110.87 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 524' ' ' GLU . . . . . 0.549 ' HG2' HD12 ' A' ' 553' ' ' LEU . 7.2 mt-10 -92.18 149.23 21.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 72.13 110.893 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -138.96 133.51 31.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 73.41 110.907 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.769 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.4 OUTLIER -109.15 106.8 16.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.131 -0.486 . . . . 52.44 110.937 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.596 HG12 HD21 ' A' ' 529' ' ' LEU . 19.9 t -95.97 113.27 29.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 63.25 111.159 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.627 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 2.9 tptm -92.46 108.57 20.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.24 110.901 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.621 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -132.45 154.55 81.6 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.608 0.718 . . . . 73.4 110.907 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 162.29 42.62 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.719 2.28 . . . . 63.52 112.382 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 103.98 1.25 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.7 2.267 . . . . 72.05 112.334 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.4 mt -103.62 -171.05 1.87 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 73.43 110.917 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 28.4 t -70.22 149.06 47.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 62.1 110.815 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -51.71 -48.45 63.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 75.42 110.848 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.1 -44.82 96.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 72.43 110.927 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 21.7 mmt85 -59.07 -55.85 29.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 73.15 110.843 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 67.4 mtp180 -53.83 -53.0 58.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.881 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.1 mt -56.41 -37.01 69.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 75.03 110.903 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.0 -46.0 83.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 73.31 110.864 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.493 HD22 ' CD2' ' A' ' 505' ' ' PHE . 22.1 tp -61.44 -50.86 71.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 61.21 110.906 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -57.3 -50.91 71.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 75.03 110.902 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -58.04 -52.71 64.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.486 . . . . 62.23 110.85 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.4 tt -52.6 -44.19 65.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 61.32 110.913 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -60.43 -56.29 23.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 73.21 110.928 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.01 -13.43 59.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 71.44 111.142 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.9 t -79.66 -57.72 3.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 64.44 110.887 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -88.29 -52.18 5.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.118 -0.492 . . . . 73.3 110.91 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.532 HD21 HG11 ' A' ' 491' ' ' VAL . 0.8 OUTLIER -67.82 -12.43 60.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 74.41 110.944 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 26.8 mmtp 56.74 24.0 8.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 74.41 110.867 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.77 177.72 1.98 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 73.43 111.076 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 40.8 m -140.28 110.87 6.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 71.04 111.136 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.51 102.03 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 64.44 111.137 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 553' ' ' LEU . . . . . 0.549 HD12 ' HG2' ' A' ' 524' ' ' GLU . 28.6 mt -77.85 -43.25 30.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 75.4 110.917 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -168.55 176.44 5.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 53.22 111.109 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 99.2 p -160.18 153.94 22.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 60.11 110.864 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.753 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 8.2 pm0 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 74.23 110.895 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.465 -0.254 . . . . 54.53 112.465 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 481' ' ' THR . . . . . 0.464 HG23 ' O ' ' A' ' 556' ' ' GLU . 25.7 m -128.52 113.4 15.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.825 0.345 . . . . 74.0 111.116 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.795 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -94.91 142.64 27.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 64.31 111.123 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -132.11 110.67 10.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.244 -0.435 . . . . 74.42 110.921 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.638 HG22 ' OE2' ' A' ' 524' ' ' GLU . 0.2 OUTLIER -96.73 114.78 26.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 63.24 111.123 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.442 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.7 pt? -135.76 142.56 44.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 62.34 110.962 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -88.3 146.94 25.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 63.53 110.865 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -152.54 169.73 21.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 44.44 111.131 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -70.49 160.66 80.61 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.669 0.747 . . . . 70.23 110.861 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -10.95 29.76 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.669 2.246 . . . . 74.32 112.301 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -71.29 -31.15 67.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 73.22 110.872 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 23.7 t -86.83 134.77 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.139 -0.482 . . . . 75.31 111.134 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -127.06 177.56 6.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.445 . . . . 74.44 110.9 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 81.8 t -51.96 -50.01 35.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 54.04 111.131 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -53.72 -40.07 65.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 73.55 110.923 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 63.7 m -67.52 -42.8 82.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 72.43 111.162 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.542 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.6 mt -61.21 -51.06 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 63.11 110.933 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 497' ' ' ARG . . . . . 0.401 ' HB3' HD12 ' A' ' 512' ' ' ILE . 9.4 ptm180 -64.1 -40.12 95.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 72.12 110.85 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -60.46 -44.12 96.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 65.44 110.835 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -70.81 -39.55 73.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.441 . . . . 72.31 110.877 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.545 HD12 HD11 ' A' ' 512' ' ' ILE . 36.0 mt -58.87 -49.9 76.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 73.34 110.917 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -72.13 -37.98 69.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 74.31 110.886 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -56.06 -48.75 75.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 61.1 110.914 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.537 ' HE2' HD13 ' A' ' 543' ' ' LEU . 13.7 mmmt -69.71 -23.7 63.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.473 . . . . 73.21 110.948 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.0 -17.68 19.64 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.758 -0.734 . . . . 62.22 112.495 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -63.4 160.26 43.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.628 0.728 . . . . 62.14 110.881 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 93.39 0.52 Allowed 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.673 2.249 . . . . 43.23 112.348 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.16 -28.23 3.41 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.705 -0.76 . . . . 52.31 112.468 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -70.43 -51.74 27.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.718 0.294 . . . . 74.44 110.888 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.38 -34.34 67.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 75.03 110.932 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.652 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -61.46 172.32 1.2 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 62.32 111.107 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.97 116.47 44.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 55.53 111.101 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.545 HD11 HD12 ' A' ' 500' ' ' LEU . 65.5 mt -98.36 123.2 50.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 73.43 111.158 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.7 m -113.91 143.15 45.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 62.03 111.12 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -98.16 128.91 44.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 73.4 110.923 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.72 92.27 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 72.42 111.16 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.7 114.85 5.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 61.44 110.929 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.606 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -88.64 161.17 42.79 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.56 0.695 . . . . 64.13 111.128 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.606 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.76 72.17 1.47 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.762 2.308 . . . . 73.31 112.325 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.4 t 177.23 141.9 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 74.12 111.15 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.87 31.35 2.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 52.32 111.138 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -126.06 -35.67 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 71.13 111.06 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.582 ' O ' HG23 ' A' ' 519' ' ' THR . 18.0 m-85 -150.1 150.55 31.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.226 -0.443 . . . . 63.42 110.898 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.18 161.76 34.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 70.32 110.859 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 524' ' ' GLU . . . . . 0.667 ' OE1' HD12 ' A' ' 553' ' ' LEU . 41.1 tp10 -94.71 152.38 18.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 64.51 110.869 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -136.31 126.94 27.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 72.23 110.868 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.795 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -98.61 107.46 19.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 72.43 110.896 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.554 HG12 HD21 ' A' ' 529' ' ' LEU . 21.4 t -95.88 112.02 27.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 75.41 111.114 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.61 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 0.8 OUTLIER -91.55 108.44 19.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.16 -0.473 . . . . 71.32 110.903 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.652 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.3 mt -131.86 154.47 81.77 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.605 0.717 . . . . 74.23 110.893 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 162.22 42.94 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.675 2.25 . . . . 63.44 112.352 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 106.45 1.67 Allowed 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.733 2.289 . . . . 70.42 112.317 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -108.83 -171.02 1.77 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 74.34 110.941 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 53.7 m -71.79 153.83 41.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 74.55 110.848 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -52.27 -47.44 65.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.128 -0.487 . . . . 60.31 110.844 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -58.95 -37.77 77.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 72.31 110.926 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.4 mmp_? -64.22 -58.04 7.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 71.22 110.839 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -53.1 -47.02 68.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 73.21 110.873 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mt -66.01 -37.04 84.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 63.33 110.882 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -65.97 -46.66 77.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.831 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -63.99 -51.18 65.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 73.23 110.921 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -58.14 -50.45 73.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 71.54 110.854 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -58.05 -53.41 58.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 72.02 110.878 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 543' ' ' LEU . . . . . 0.537 HD13 ' HE2' ' A' ' 503' ' ' LYS . 7.9 mt -52.63 -43.59 65.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 71.32 110.941 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.53 -56.56 19.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 75.41 110.857 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.26 -13.32 60.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 61.31 111.1 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 22.8 t -79.6 -57.39 3.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 75.22 110.845 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -88.4 -52.18 5.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 74.22 110.879 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -12.36 60.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 71.55 110.91 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.5 mmmt 57.11 23.58 8.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 71.24 110.894 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.95 177.86 1.57 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.44 111.077 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 49.1 m -140.39 111.01 6.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 75.13 111.12 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 61.8 t -60.47 119.56 4.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 63.11 111.108 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 553' ' ' LEU . . . . . 0.667 HD12 ' OE1' ' A' ' 524' ' ' GLU . 17.6 mt -103.09 -48.03 4.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 55.12 110.89 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -143.61 170.09 16.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 64.1 111.073 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 54.8 p -175.8 133.99 0.28 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 64.14 110.851 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.464 ' O ' HG23 ' A' ' 481' ' ' THR . 4.3 pt-20 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 73.05 110.877 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 N-CA-C 112.477 -0.249 . . . . 71.2 112.477 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 97.0 m -129.95 106.89 8.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.783 0.325 . . . . 73.4 111.126 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.708 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -94.97 136.42 35.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 54.52 111.121 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -124.2 111.18 15.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.252 -0.431 . . . . 73.1 110.906 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.504 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.5 OUTLIER -94.92 110.97 22.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 73.2 111.172 -180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.441 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -135.73 146.38 47.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.246 -0.434 . . . . 63.24 110.937 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.59 ' HD3' HD11 ' A' ' 553' ' ' LEU . 26.1 mtp180 -97.4 127.22 43.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.16 -0.473 . . . . 73.53 110.868 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 487' ' ' ALA . . . . . 0.448 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -123.84 171.06 9.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 61.32 111.134 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -66.29 160.63 63.88 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.667 0.746 . . . . 72.25 110.901 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -16.3 37.63 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.692 2.261 . . . . 73.22 112.366 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -72.5 -34.02 67.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 64.44 110.887 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 85.4 t -80.14 124.59 38.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.475 . . . . 71.53 111.132 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -118.61 178.85 4.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 74.54 110.878 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 38.7 t -51.62 -48.73 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 75.24 111.158 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -51.71 -41.12 61.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 65.54 110.882 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.4 m -71.09 -34.55 71.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 54.3 111.14 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.778 ' HB3' HD13 ' A' ' 512' ' ' ILE . 2.3 mt -67.48 -44.54 78.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.451 . . . . 72.15 110.872 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -70.08 -45.55 66.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 65.21 110.849 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -65.05 -32.62 74.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 72.15 110.84 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -73.58 -46.3 48.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 74.02 110.884 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.7 -42.3 98.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 74.45 110.893 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.24 -37.55 66.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 71.35 110.907 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -60.58 -49.31 78.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 75.13 110.897 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -24.02 67.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 72.44 110.918 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.07 -17.73 19.43 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.794 -0.717 . . . . 75.32 112.518 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.464 ' CD2' HD22 ' A' ' 540' ' ' LEU . 15.3 m-85 -68.01 160.3 75.05 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.666 0.746 . . . . 60.44 110.852 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 100.25 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.693 2.262 . . . . 72.21 112.29 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -119.85 -25.19 2.62 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.757 -0.735 . . . . 55.14 112.458 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -72.88 -40.18 65.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.735 0.302 . . . . 71.22 110.914 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -85.23 -34.29 22.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 75.2 110.873 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.633 ' HB1' ' O ' ' A' ' 528' ' ' LYS . . . -61.43 -177.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.445 . . . . 64.33 111.087 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 23.4 t -126.98 143.06 41.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 54.32 111.108 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.778 HD13 ' HB3' ' A' ' 496' ' ' LEU . 30.6 mt -125.61 120.4 57.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.174 -0.466 . . . . 52.54 111.129 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.53 141.6 48.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 74.3 111.163 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -100.37 141.65 32.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 70.53 110.91 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 93.2 t -135.0 108.55 10.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 71.53 111.164 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 12.4 tm0? -71.19 116.74 11.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 74.43 110.947 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.581 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -96.22 160.23 30.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.575 0.702 . . . . 61.14 111.129 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.581 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.8 Cg_endo -69.76 74.6 1.28 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.663 2.242 . . . . 60.54 112.306 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.538 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.3 t 179.99 138.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 73.23 111.1 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.48 27.18 3.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 64.13 111.09 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.53 -34.93 3.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 75.12 111.081 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.538 ' O ' HG23 ' A' ' 519' ' ' THR . 14.1 m-85 -144.98 164.75 30.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 73.42 110.943 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 48.9 mtm180 -137.33 160.61 38.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 63.31 110.898 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -93.98 149.31 21.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 72.02 110.886 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.448 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 83.1 m-85 -142.43 134.57 27.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 72.23 110.848 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.708 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -108.36 107.72 18.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.095 -0.502 . . . . 64.13 110.91 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.575 HG12 HD21 ' A' ' 529' ' ' LEU . 21.3 t -96.2 112.46 28.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 72.45 111.1 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.633 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 34.7 tttt -91.93 108.93 20.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.479 . . . . 73.33 110.901 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.632 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.3 mt -131.89 154.42 81.74 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.631 0.729 . . . . 52.13 110.89 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 162.25 42.79 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.627 2.218 . . . . 71.22 112.341 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 112.42 3.08 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.678 2.252 . . . . 64.11 112.308 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.79 -170.98 1.77 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 63.14 110.91 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 40.9 t -68.88 155.51 40.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 35.02 110.844 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -54.73 -50.31 68.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 54.14 110.905 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -60.06 -37.16 79.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.458 . . . . 64.31 110.881 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -64.19 -55.6 20.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 75.4 110.893 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 53.7 mtm180 -55.81 -53.06 61.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 73.54 110.844 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.0 mt -59.23 -37.77 78.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 71.12 110.897 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.93 -50.07 67.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 65.44 110.877 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.464 HD22 ' CD2' ' A' ' 505' ' ' PHE . 23.0 tp -57.92 -51.08 71.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 60.21 110.922 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 541' ' ' GLU . . . . . 0.402 ' OE1' HG22 ' A' ' 552' ' ' VAL . 17.2 mm-40 -57.26 -50.89 71.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.454 . . . . 74.21 110.869 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -57.88 -51.91 67.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 52.42 110.878 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.8 -44.65 66.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 71.1 110.851 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -60.39 -56.35 22.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 73.43 110.878 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.87 -13.47 59.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 73.34 111.102 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.61 -57.96 3.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 75.21 110.859 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -88.26 -52.2 5.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.489 . . . . 75.35 110.907 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.76 -12.47 60.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 73.54 110.871 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt 56.3 24.37 8.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 75.12 110.905 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.41 174.14 3.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 72.42 111.091 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 93.3 m -133.72 111.69 10.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 73.41 111.13 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 552' ' ' VAL . . . . . 0.402 HG22 ' OE1' ' A' ' 541' ' ' GLU . 42.8 t -59.98 109.04 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 50.41 111.15 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 553' ' ' LEU . . . . . 0.59 HD11 ' HD3' ' A' ' 486' ' ' ARG . 11.7 mt -86.84 -45.38 10.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 75.41 110.922 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.61 172.38 14.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 70.13 111.144 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 20.6 p -158.26 157.37 32.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 73.24 110.877 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 75.43 110.892 -179.951 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.51 -0.236 . . . . 63.3 112.51 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 25.0 m -127.25 108.65 11.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.835 0.35 . . . . 63.15 111.147 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.622 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -95.41 129.99 42.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 74.45 111.151 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -118.24 113.32 21.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.244 -0.434 . . . . 74.42 110.936 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -94.38 110.33 22.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 71.12 111.115 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.503 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -130.51 143.6 50.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 75.55 110.933 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -94.1 126.77 39.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 73.23 110.894 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -127.02 170.95 11.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 74.42 111.141 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -61.21 160.42 22.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.666 0.746 . . . . 75.14 110.881 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -17.76 37.36 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.698 2.265 . . . . 52.12 112.303 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -73.02 -44.15 61.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 73.0 110.944 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.436 HG21 ' HG ' ' A' ' 548' ' ' LEU . 95.7 t -60.71 125.55 17.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 41.53 111.143 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -123.48 176.68 6.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 71.42 110.862 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 90.3 t -51.63 -49.24 35.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.487 . . . . 73.5 111.096 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -51.17 -40.27 58.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 73.52 110.911 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.3 m -72.96 -35.12 66.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 73.24 111.154 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.587 ' HB3' HD13 ' A' ' 512' ' ' ILE . 4.8 mt -67.46 -44.1 79.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 54.41 110.908 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.05 -46.13 62.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 61.54 110.888 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -63.97 -33.21 75.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 71.42 110.907 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -73.98 -47.44 37.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.465 . . . . 73.42 110.835 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 35.8 mt -59.6 -43.35 93.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 71.04 110.91 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -73.09 -37.76 66.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.169 -0.469 . . . . 71.53 110.92 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.35 -49.04 78.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 65.25 110.871 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.693 ' NZ ' HD13 ' A' ' 543' ' ' LEU . 0.2 OUTLIER -68.2 -24.76 64.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 74.34 110.901 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -17.98 19.34 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.754 -0.736 . . . . 73.04 112.475 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -61.54 160.28 26.81 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.66 0.743 . . . . 71.44 110.846 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 86.87 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.672 2.248 . . . . 72.32 112.32 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -108.89 -22.09 7.12 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.745 -0.74 . . . . 74.23 112.494 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -75.85 -40.79 54.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.727 0.299 . . . . 75.4 110.839 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -85.28 -29.45 24.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.427 . . . . 74.2 110.887 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.632 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -62.77 173.8 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.466 . . . . 64.02 111.078 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.05 117.04 46.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.42 111.152 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.587 HD13 ' HB3' ' A' ' 496' ' ' LEU . 62.1 mt -96.91 137.33 24.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 75.3 111.071 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.13 150.35 52.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 72.41 111.146 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -102.5 144.0 31.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.913 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.5 t -138.62 108.95 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 71.2 111.136 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -77.56 107.42 10.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 65.21 110.929 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.576 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -88.9 160.22 44.13 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.578 0.704 . . . . 72.43 111.103 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.576 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.1 Cg_endo -69.71 74.54 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.68 2.254 . . . . 72.33 112.353 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.1 t -176.03 140.05 0.4 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 75.14 111.136 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -99.95 26.31 6.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 62.45 111.096 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.69 -34.02 3.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 73.22 111.1 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.582 ' O ' HG23 ' A' ' 519' ' ' THR . 12.0 m-85 -145.1 157.28 44.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 74.41 110.925 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.16 157.43 34.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 74.31 110.873 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 524' ' ' GLU . . . . . 0.481 ' CD ' ' HB2' ' A' ' 517' ' ' ALA . 12.4 mt-10 -93.73 141.86 28.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 70.12 110.901 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.448 ' O ' HD23 ' A' ' 485' ' ' LEU . 83.6 m-85 -130.46 128.95 42.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 71.15 110.846 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.622 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.6 OUTLIER -104.15 105.51 15.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 75.25 110.957 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.534 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.2 t -95.98 116.68 38.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 72.15 111.148 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.588 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 5.7 tptm -94.74 107.41 19.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 65.41 110.896 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.632 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.4 mt -130.65 154.29 81.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.56 0.695 . . . . 70.31 110.939 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 162.14 43.25 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.646 2.231 . . . . 61.21 112.341 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 108.83 2.17 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.682 2.254 . . . . 63.42 112.338 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.2 mt -109.41 -171.08 1.77 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 63.51 110.93 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.84 154.88 40.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 54.53 110.82 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -51.98 -46.08 64.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.096 -0.502 . . . . 71.21 110.875 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.85 -36.12 78.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 65.32 110.877 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -65.04 -54.35 31.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 72.24 110.888 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 43.0 mtt180 -57.16 -48.11 79.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 64.34 110.865 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.7 mt -63.8 -43.59 95.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 73.21 110.888 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -62.92 -44.51 95.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 71.51 110.892 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.2 tp -62.35 -51.23 68.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.157 -0.474 . . . . 53.05 110.938 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -56.08 -49.66 73.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 74.31 110.919 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -57.93 -51.91 67.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 72.23 110.857 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 543' ' ' LEU . . . . . 0.693 HD13 ' NZ ' ' A' ' 503' ' ' LYS . 0.5 OUTLIER -52.88 -44.35 66.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 63.12 110.9 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -60.31 -56.74 17.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 72.03 110.84 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.18 -13.11 59.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 70.34 111.122 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.73 -58.31 3.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 60.44 110.816 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -88.56 -52.17 5.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 75.14 110.828 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.436 ' HG ' HG21 ' A' ' 491' ' ' VAL . 1.8 tp -67.76 -12.71 61.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 74.4 110.919 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp 56.65 23.36 7.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.22 110.904 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -71.2 -179.82 2.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 62.42 111.125 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 94.2 m -144.99 111.29 5.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 73.14 111.144 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.4 t -53.23 122.81 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 75.31 111.158 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 553' ' ' LEU . . . . . 0.454 HD12 ' HG2' ' A' ' 524' ' ' GLU . 18.2 mt -101.28 -47.55 4.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 70.12 110.893 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -158.28 175.15 14.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 64.42 111.092 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 88.5 p -161.33 152.71 18.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.443 . . . . 75.24 110.867 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 73.43 110.845 -179.948 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 N-CA-C 112.481 -0.247 . . . . 74.1 112.481 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 95.6 m -130.04 112.59 13.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.792 0.33 . . . . 54.53 111.135 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.529 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -94.95 143.89 26.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 64.43 111.085 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -131.44 116.41 17.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 74.0 110.916 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.616 HG22 ' CD ' ' A' ' 524' ' ' GLU . 0.2 OUTLIER -98.1 112.48 24.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.124 -0.489 . . . . 55.31 111.13 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.459 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -134.78 147.8 50.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 35.34 110.967 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.446 ' NH2' HG21 ' A' ' 519' ' ' THR . 6.8 ttt180 -93.17 136.23 33.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.455 . . . . 65.34 110.883 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -139.67 161.86 36.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 54.53 111.105 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 488' ' ' GLU . . . . . 0.572 ' HG2' HG23 ' A' ' 491' ' ' VAL . 5.2 pm0 -51.98 156.87 2.35 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.685 0.755 . . . . 73.44 110.879 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -8.82 24.57 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.65 2.234 . . . . 73.22 112.339 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -82.43 -42.4 18.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 75.35 110.881 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.572 HG23 ' HG2' ' A' ' 488' ' ' GLU . 97.7 t -64.16 124.09 18.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 51.22 111.14 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -120.55 177.42 5.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.203 -0.453 . . . . 74.22 110.865 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.683 HG13 ' HB ' ' A' ' 512' ' ' ILE . 47.7 t -51.46 -47.49 35.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 64.51 111.113 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -51.83 -41.65 61.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.23 110.852 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.9 m -70.79 -34.46 71.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 43.14 111.123 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.555 HD13 ' CG2' ' A' ' 512' ' ' ILE . 2.6 mt -67.2 -45.42 76.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 73.24 110.9 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 -69.89 -45.42 67.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 72.25 110.83 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -64.93 -31.94 73.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 72.05 110.9 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 499' ' ' PHE . . . . . 0.505 ' HZ ' HD22 ' A' ' 543' ' ' LEU . 36.9 t80 -75.17 -43.24 53.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 73.31 110.868 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 51.0 mt -63.48 -43.96 95.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.465 . . . . 72.44 110.885 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -71.71 -42.07 67.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 71.21 110.9 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.89 -49.0 78.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 71.24 110.868 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -66.24 -23.98 66.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.462 . . . . 72.21 110.896 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -18.67 18.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.706 -0.759 . . . . 74.54 112.472 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -67.52 160.25 73.42 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.682 0.753 . . . . 73.25 110.851 -179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 101.7 0.94 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.671 2.247 . . . . 71.32 112.335 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -123.51 -33.06 0.84 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.719 -0.753 . . . . 41.41 112.496 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 20.5 pttt -61.52 -43.5 98.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.746 0.308 . . . . 73.13 110.911 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -83.38 -31.51 26.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 72.2 110.883 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.587 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -55.79 172.06 0.19 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 42.4 111.114 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.6 t -126.93 111.09 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 72.14 111.109 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.683 ' HB ' HG13 ' A' ' 493' ' ' VAL . 34.5 mt -92.28 142.45 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 52.44 111.147 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.53 134.83 36.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 74.35 111.157 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -91.52 142.76 27.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 62.52 110.883 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 61.7 t -138.15 108.27 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 70.04 111.168 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -74.9 132.68 41.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.919 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.577 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -116.1 160.3 36.11 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.593 0.711 . . . . 42.42 111.099 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.577 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.79 74.45 1.3 Allowed 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.65 2.234 . . . . 64.21 112.358 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.446 HG21 ' NH2' ' A' ' 486' ' ' ARG . 3.0 t -179.83 141.77 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.254 -0.43 . . . . 64.14 111.16 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -101.04 29.02 4.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 73.45 111.142 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.6 -34.66 3.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 71.23 111.084 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -146.38 166.09 27.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.442 . . . . 71.4 110.929 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 19.8 mtm-85 -136.83 160.92 37.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 72.41 110.873 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 524' ' ' GLU . . . . . 0.616 ' CD ' HG22 ' A' ' 484' ' ' THR . 6.8 tp10 -93.94 140.21 29.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 70.35 110.903 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -130.8 132.42 45.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.115 -0.493 . . . . 73.44 110.907 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.614 HD23 HG23 ' A' ' 484' ' ' THR . 0.6 OUTLIER -112.99 107.05 15.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 73.23 110.904 -179.975 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.533 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.1 t -97.35 133.5 38.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 63.14 111.098 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.511 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 43.6 tttt -108.65 107.94 18.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 73.24 110.93 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.587 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -129.7 154.61 80.98 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.628 0.728 . . . . 75.12 110.89 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.28 42.67 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.716 2.278 . . . . 50.5 112.306 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 110.95 2.67 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.679 2.252 . . . . 64.03 112.361 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.6 mt -114.28 -170.99 1.83 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.429 . . . . 72.3 110.915 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.1 p -74.55 154.03 38.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 62.43 110.862 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -51.92 -40.62 61.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 70.32 110.839 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -61.25 -42.88 99.38 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.455 . . . . 73.42 110.926 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -63.34 -52.58 61.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 61.13 110.903 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -54.5 -52.95 60.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 62.32 110.845 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.36 -36.18 82.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 54.55 110.913 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -64.54 -49.84 69.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 72.01 110.903 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -62.53 -51.0 69.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 75.44 110.975 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -56.37 -47.71 78.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 70.53 110.891 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -59.87 -53.89 52.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 73.21 110.848 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 543' ' ' LEU . . . . . 0.505 HD22 ' HZ ' ' A' ' 499' ' ' PHE . 0.8 OUTLIER -52.66 -44.08 65.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 53.12 110.898 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.26 -56.46 21.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.44 110.887 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.14 -13.37 60.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 75.4 111.16 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 20.0 t -79.57 -57.54 3.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 71.42 110.829 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -88.38 -52.26 5.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 75.14 110.899 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.498 HD21 HG11 ' A' ' 491' ' ' VAL . 1.2 tp -67.76 -12.46 60.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.111 -0.495 . . . . 62.04 110.952 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 23.1 mmtp 57.16 23.46 8.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 65.52 110.893 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.32 178.39 1.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.454 . . . . 63.32 111.094 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 90.8 m -145.01 110.91 5.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 74.13 111.154 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 36.4 t -54.73 131.88 17.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 63.51 111.117 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 46.5 mt -115.18 -43.6 3.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 72.11 110.888 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -157.44 174.85 14.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 64.24 111.087 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 5.2 p -169.27 148.63 3.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 71.54 110.813 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.113 -0.494 . . . . 65.22 110.927 179.988 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.544 -0.222 . . . . 40.35 112.544 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 33.2 m -125.19 108.35 11.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.788 0.328 . . . . 73.31 111.116 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.518 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -96.75 125.22 41.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 74.21 111.073 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -114.82 112.36 22.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 73.11 110.929 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.493 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.6 OUTLIER -95.41 112.92 24.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 43.3 111.166 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.469 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -134.01 143.2 47.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.246 -0.434 . . . . 64.25 110.924 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -89.27 142.58 27.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 71.4 110.842 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 487' ' ' ALA . . . . . 0.786 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -141.66 166.65 24.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.156 -0.475 . . . . 72.33 111.148 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -55.88 160.55 4.27 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.674 0.749 . . . . 73.35 110.876 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -17.67 37.19 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.632 2.222 . . . . 62.14 112.358 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -76.13 -40.45 52.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 71.34 110.955 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.466 HG11 HD21 ' A' ' 548' ' ' LEU . 82.7 t -59.22 137.33 21.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 72.22 111.091 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -133.65 175.65 9.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 60.23 110.904 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 85.1 t -51.92 -47.76 40.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.463 . . . . 61.42 111.146 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -54.12 -39.67 66.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 65.44 110.901 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 85.5 m -67.01 -43.13 83.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 74.31 111.143 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.698 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.4 mt -62.63 -51.08 68.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.45 . . . . 73.13 110.927 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -64.42 -36.28 83.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 74.12 110.897 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -63.95 -45.71 87.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 71.34 110.869 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -70.08 -36.13 74.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 74.42 110.856 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.597 HD12 HD11 ' A' ' 512' ' ' ILE . 43.4 mt -62.89 -52.93 61.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.166 -0.47 . . . . 71.03 110.947 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -68.71 -38.01 79.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.471 . . . . 75.32 110.852 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.88 -47.51 84.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.55 110.934 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -67.82 -25.08 65.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 74.54 110.908 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 113.96 -18.28 19.23 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.754 -0.736 . . . . 71.01 112.505 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -62.96 160.28 39.4 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.655 0.74 . . . . 72.43 110.867 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 91.31 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 65.42 112.303 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -108.76 -30.17 3.84 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.733 -0.746 . . . . 70.42 112.518 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -62.73 -51.96 65.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.768 0.318 . . . . 71.1 110.908 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -75.37 -29.89 60.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 72.24 110.918 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.618 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -57.43 168.66 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 50.54 111.119 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.01 111.13 24.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 72.2 111.109 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.698 HD13 ' HB3' ' A' ' 496' ' ' LEU . 53.8 mt -99.47 134.66 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.474 . . . . 74.14 111.14 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 4.0 m -134.68 155.24 50.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.182 -0.463 . . . . 70.03 111.105 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.85 143.99 31.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 74.03 110.922 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 515' ' ' VAL . . . . . 0.529 HG11 ' OE2' ' A' ' 524' ' ' GLU . 91.0 t -136.96 127.01 39.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 75.14 111.115 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -80.98 99.13 8.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 74.14 110.899 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.573 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -79.62 160.26 70.05 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.573 0.701 . . . . 54.11 111.081 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.573 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.2 Cg_endo -69.7 74.47 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.681 2.254 . . . . 73.41 112.365 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.561 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.1 t -177.32 139.23 0.25 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 73.42 111.151 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.0 24.98 6.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 50.33 111.105 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.19 -35.49 2.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 60.32 111.082 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.561 ' O ' HG23 ' A' ' 519' ' ' THR . 7.9 m-85 -136.83 161.41 36.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 72.51 110.891 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -123.75 155.56 37.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 72.4 110.895 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 524' ' ' GLU . . . . . 0.529 ' OE2' HG11 ' A' ' 515' ' ' VAL . 33.2 tt0 -90.55 144.46 25.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 72.02 110.887 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.786 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 90.4 m-85 -130.2 124.55 32.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 74.4 110.866 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.518 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -101.14 105.09 16.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.114 -0.494 . . . . 64.41 110.926 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.538 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.02 123.81 48.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 71.54 111.096 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.53 ' O ' HD23 ' A' ' 529' ' ' LEU . 18.2 tttp -102.68 108.56 19.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 73.54 110.904 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.618 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.4 mt -132.06 154.45 81.69 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.622 0.725 . . . . 74.52 110.89 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 162.14 43.2 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.682 2.254 . . . . 64.43 112.333 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 107.28 1.83 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.676 2.251 . . . . 62.55 112.362 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 5.1 mt -109.85 -171.03 1.76 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.235 -0.439 . . . . 72.1 110.928 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.01 153.69 41.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 74.24 110.871 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -52.09 -45.86 65.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.146 -0.479 . . . . 74.03 110.867 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -60.05 -37.46 79.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.176 -0.466 . . . . 73.31 110.903 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -65.65 -57.47 8.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 72.0 110.849 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -53.25 -46.43 69.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 74.32 110.892 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -67.02 -38.8 86.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 73.43 110.96 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -64.08 -46.4 84.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 75.35 110.887 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.12 -51.06 63.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.48 . . . . 75.54 110.911 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -58.34 -49.05 78.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 73.2 110.896 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -58.76 -53.73 55.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 72.54 110.872 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.1 mt -52.75 -43.66 65.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 44.33 110.894 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.31 -56.39 22.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 64.32 110.898 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.58 -13.23 60.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 61.41 111.091 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.6 t -79.55 -56.84 4.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 64.02 110.873 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -88.37 -52.16 5.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 73.41 110.91 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.466 HD21 HG11 ' A' ' 491' ' ' VAL . 1.0 OUTLIER -67.96 -12.17 60.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 63.41 110.905 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt 57.57 23.46 9.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 72.24 110.877 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -64.58 -179.55 0.5 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 53.44 111.1 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 90.5 m -144.71 110.88 5.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 72.51 111.188 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.8 t -57.04 118.87 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 72.03 111.172 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 55.8 mt -99.75 -47.7 4.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 73.01 110.874 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.53 173.45 16.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 71.51 111.106 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 6.1 p -165.49 149.95 8.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 74.25 110.85 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.1 -0.5 . . . . 73.1 110.904 -179.995 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 N-CA-C 112.482 -0.247 . . . . 72.14 112.482 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 481' ' ' THR . . . . . 0.409 HG23 ' O ' ' A' ' 556' ' ' GLU . 7.1 m -122.84 107.54 11.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.776 0.322 . . . . 62.32 111.141 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.3 130.09 42.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 54.12 111.128 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -120.32 110.53 16.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 74.5 110.902 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.8 m -94.26 111.35 23.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 74.34 111.18 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.495 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -130.31 143.16 50.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 70.33 110.962 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.516 ' HB2' HD11 ' A' ' 553' ' ' LEU . 12.1 ttt180 -89.67 148.02 23.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 73.51 110.828 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 487' ' ' ALA . . . . . 0.737 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -153.35 169.64 22.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 74.24 111.102 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -62.6 160.54 34.06 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.646 0.736 . . . . 63.34 110.9 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -17.6 37.37 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.67 2.247 . . . . 65.34 112.358 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 38.8 m-20 -69.18 -45.73 69.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 72.43 110.913 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.522 HG11 HD21 ' A' ' 548' ' ' LEU . 42.7 t -65.22 129.56 29.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 71.22 111.127 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -124.16 177.29 5.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.21 110.886 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.458 HG13 ' HB ' ' A' ' 512' ' ' ILE . 93.8 t -51.7 -48.07 37.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 71.31 111.137 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -52.02 -41.05 61.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.899 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 95.4 m -68.95 -39.55 79.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 62.02 111.145 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.743 ' HB3' HD13 ' A' ' 512' ' ' ILE . 10.2 mt -64.03 -51.08 65.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 54.42 110.916 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -65.09 -40.95 95.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 75.43 110.85 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -61.34 -43.27 99.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 64.42 110.828 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -70.51 -37.75 74.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 73.32 110.932 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.569 HD12 HD11 ' A' ' 512' ' ' ILE . 33.9 mt -61.33 -51.82 67.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 71.13 110.89 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -69.62 -37.98 77.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 74.41 110.879 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -57.39 -48.96 77.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.485 . . . . 61.31 110.897 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.666 ' NZ ' HD22 ' A' ' 543' ' ' LEU . 17.2 mmtp -67.36 -24.05 65.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.191 -0.459 . . . . 63.03 110.89 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.1 -18.3 18.85 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.725 -0.75 . . . . 53.15 112.473 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.406 ' CD2' HD22 ' A' ' 540' ' ' LEU . 18.5 m-85 -64.54 160.21 53.98 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.682 0.753 . . . . 73.44 110.844 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 96.06 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.689 2.259 . . . . 63.03 112.357 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.76 -41.23 0.94 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.746 -0.74 . . . . 75.22 112.506 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -40.28 84.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.71 0.291 . . . . 74.44 110.877 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -83.75 -26.37 29.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 73.21 110.896 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.614 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -66.28 173.17 3.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 62.55 111.108 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.02 113.01 30.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 74.42 111.129 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.743 HD13 ' HB3' ' A' ' 496' ' ' LEU . 46.6 mt -102.29 132.96 47.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 62.23 111.096 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -127.76 141.77 51.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.14 -0.482 . . . . 71.24 111.154 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -92.92 126.15 37.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.266 -0.424 . . . . 74.14 110.921 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 92.8 t -116.35 99.22 7.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 62.23 111.118 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.24 113.71 10.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 64.34 110.892 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -94.3 160.31 32.17 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.588 0.709 . . . . 63.43 111.091 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.2 Cg_endo -69.82 74.53 1.31 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.687 2.258 . . . . 63.1 112.305 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.5 t -177.0 137.17 0.23 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 52.34 111.171 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.77 28.1 3.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 74.4 111.116 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.43 -34.66 3.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 73.42 111.06 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.544 ' O ' HG23 ' A' ' 519' ' ' THR . 15.4 m-85 -147.97 166.37 27.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.417 . . . . 54.31 110.872 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -140.35 159.67 41.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 71.53 110.868 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 524' ' ' GLU . . . . . 0.424 ' HG2' HD12 ' A' ' 553' ' ' LEU . 9.3 mt-10 -93.24 141.47 28.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 34.43 110.881 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.737 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 94.4 m-85 -127.31 124.34 38.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 73.32 110.869 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.23 111.58 23.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.121 -0.491 . . . . 71.1 110.936 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.557 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.5 t -104.17 117.0 49.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 64.13 111.094 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.56 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 5.3 ttmm -97.87 109.3 22.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.899 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.614 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.5 mt -131.71 154.38 81.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.657 0.741 . . . . 72.25 110.893 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 162.17 43.11 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.661 2.241 . . . . 72.43 112.352 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 105.28 1.47 Allowed 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.648 2.232 . . . . 73.3 112.361 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.7 mt -107.32 -171.06 1.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 74.1 110.937 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 46.4 t -71.18 151.24 44.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 52.51 110.862 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.93 -47.54 64.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 75.54 110.877 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -58.38 -41.05 83.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.162 -0.472 . . . . 73.12 110.913 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -64.44 -53.32 50.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 61.23 110.894 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 8.9 mtt85 -53.28 -52.99 57.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 73.13 110.908 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.2 mt -63.85 -34.42 77.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.183 -0.462 . . . . 73.43 110.894 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -65.86 -46.79 77.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 73.03 110.9 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.406 HD22 ' CD2' ' A' ' 505' ' ' PHE . 26.3 tp -64.86 -51.09 63.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.133 -0.485 . . . . 75.31 110.913 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -56.68 -49.39 75.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.455 . . . . 55.43 110.885 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -58.0 -53.41 58.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.462 . . . . 74.5 110.898 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 543' ' ' LEU . . . . . 0.666 HD22 ' NZ ' ' A' ' 503' ' ' LYS . 9.3 mt -52.79 -43.27 65.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 71.1 110.912 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.55 -56.51 20.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 72.02 110.88 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.58 -13.23 60.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.119 -0.492 . . . . 61.25 111.073 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 23.2 t -79.55 -56.96 3.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 74.05 110.87 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -88.33 -52.2 5.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 64.14 110.875 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.522 HD21 HG11 ' A' ' 491' ' ' VAL . 1.9 tp -67.9 -12.28 60.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.129 -0.487 . . . . 70.44 110.893 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt 57.58 23.32 9.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 73.11 110.903 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -65.3 -179.73 0.64 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.437 . . . . 60.34 111.092 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 86.2 m -145.12 110.94 5.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.1 111.146 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 62.1 t -57.59 126.76 15.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 75.43 111.122 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 553' ' ' LEU . . . . . 0.516 HD11 ' HB2' ' A' ' 486' ' ' ARG . 82.5 mt -110.72 -48.21 3.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 71.53 110.923 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -144.27 168.89 18.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 61.33 111.133 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 84.5 p -169.48 143.67 2.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 55.04 110.893 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.409 ' O ' HG23 ' A' ' 481' ' ' THR . 18.9 mt-10 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 64.33 110.883 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 N-CA-C 112.47 -0.252 . . . . 51.4 112.47 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 93.2 m -119.4 113.35 20.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 74.44 111.161 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.715 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -98.2 123.2 42.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 64.34 111.127 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -111.48 112.35 24.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 71.34 110.92 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.501 HG23 HD22 ' A' ' 526' ' ' LEU . 0.8 OUTLIER -96.45 111.48 23.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.112 -0.495 . . . . 75.03 111.144 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.485 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -130.04 142.93 50.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.945 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.6 135.79 35.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 61.01 110.863 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -144.37 170.88 15.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 60.31 111.044 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -62.32 160.55 31.68 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.671 0.748 . . . . 74.21 110.87 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -19.7 35.76 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.717 2.278 . . . . 64.23 112.337 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -64.99 -46.85 79.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 75.32 110.904 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.404 HG11 HD21 ' A' ' 548' ' ' LEU . 54.1 t -64.32 121.79 14.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 73.42 111.122 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -117.28 177.26 4.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 54.1 110.91 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 83.3 t -52.15 -48.47 42.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 74.42 111.153 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -52.35 -43.88 64.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 62.33 110.87 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 38.6 m -66.84 -41.96 86.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.48 . . . . 74.25 111.171 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.778 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.7 mt -63.57 -50.88 67.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 72.4 110.956 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 27.6 ptt180 -64.64 -35.96 82.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 65.12 110.89 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -64.7 -45.57 86.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.169 -0.469 . . . . 61.13 110.843 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -70.03 -35.98 74.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.902 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.84 HD12 HD11 ' A' ' 512' ' ' ILE . 26.4 mt -63.6 -52.79 59.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 74.5 110.929 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -68.23 -38.0 81.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 64.44 110.891 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.22 -45.76 92.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 71.4 110.868 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -68.57 -23.68 64.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 75.01 110.87 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.08 -19.07 18.24 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.694 -0.765 . . . . 22.51 112.475 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.546 ' CD2' HD22 ' A' ' 540' ' ' LEU . 15.5 m-85 -64.7 160.24 55.16 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.648 0.737 . . . . 70.1 110.86 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 97.43 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.705 2.27 . . . . 71.43 112.34 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -111.56 -35.03 1.96 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.728 -0.749 . . . . 72.51 112.474 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -64.66 -51.88 60.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.736 0.303 . . . . 73.53 110.906 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -71.66 -33.24 68.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 63.41 110.851 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.651 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -64.44 170.83 3.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.169 -0.469 . . . . 72.4 111.082 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.0 111.67 26.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 52.22 111.162 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.84 HD11 HD12 ' A' ' 500' ' ' LEU . 44.4 mt -97.53 119.89 46.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 72.32 111.164 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.24 155.43 27.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 73.24 111.128 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -114.71 142.24 46.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 54.32 110.902 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 61.8 t -134.55 113.42 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 72.21 111.156 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.19 102.18 1.63 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.135 -0.484 . . . . 70.34 110.887 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.578 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -74.0 160.27 82.15 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.616 0.722 . . . . 71.12 111.091 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.578 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.83 74.6 1.31 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.661 2.241 . . . . 75.42 112.335 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t 179.59 141.45 0.13 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 60.44 111.14 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -96.03 26.64 4.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 53.55 111.095 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.56 -35.06 3.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 71.44 111.083 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -140.03 178.57 7.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.441 . . . . 70.15 110.91 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 47.8 mtm180 -149.73 157.23 43.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 72.21 110.875 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -94.1 152.65 18.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 73.24 110.875 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.465 ' O ' HD23 ' A' ' 485' ' ' LEU . 80.7 m-85 -139.76 129.72 24.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 63.44 110.873 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.715 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -103.41 109.01 20.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.186 -0.461 . . . . 74.24 110.944 179.973 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.522 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.09 115.47 35.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 71.51 111.137 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.582 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 30.1 tttm -94.97 107.44 19.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.158 -0.474 . . . . 63.24 110.895 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.651 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -132.36 154.29 81.53 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.625 0.726 . . . . 72.31 110.934 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 162.12 43.31 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.704 2.269 . . . . 64.42 112.35 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 104.16 1.29 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.664 2.243 . . . . 72.24 112.326 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.2 mt -104.36 -171.3 1.9 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 73.05 110.943 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 30.5 m -70.24 150.87 45.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 72.22 110.841 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -52.29 -47.32 65.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 61.24 110.858 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -60.91 -49.95 75.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 45.21 110.878 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -55.24 -55.5 30.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 71.14 110.834 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 71.8 mtp180 -53.2 -52.99 57.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.467 . . . . 72.44 110.894 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 -35.2 72.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.191 -0.459 . . . . 74.32 110.907 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -65.92 -45.63 81.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 71.51 110.868 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.546 HD22 ' CD2' ' A' ' 505' ' ' PHE . 22.8 tp -63.38 -51.07 67.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.114 -0.494 . . . . 73.13 110.912 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -57.36 -50.02 74.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 75.21 110.893 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -57.96 -53.5 57.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.467 . . . . 65.13 110.853 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 543' ' ' LEU . . . . . 0.46 ' O ' HD23 ' A' ' 543' ' ' LEU . 2.0 tt -52.68 -43.23 65.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 71.11 110.898 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.66 -56.54 20.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 73.44 110.876 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.36 -13.32 60.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 63.32 111.09 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 25.1 t -79.64 -57.29 3.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 62.31 110.85 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -88.33 -52.29 5.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 52.12 110.912 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.404 HD21 HG11 ' A' ' 491' ' ' VAL . 0.4 OUTLIER -67.77 -12.44 60.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 72.45 110.966 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm 57.49 23.26 8.92 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.461 . . . . 62.11 110.882 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.29 178.7 1.43 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 63.22 111.142 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 42.4 m -143.89 110.98 5.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 55.12 111.144 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.9 t -58.18 104.01 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 74.22 111.145 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 25.1 mt -81.49 -39.08 25.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 71.21 110.926 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.59 173.2 13.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 74.45 111.083 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 1.3 t -166.06 155.81 12.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 72.04 110.87 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.566 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 7.0 pt-20 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.47 . . . . 64.22 110.884 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 N-CA-C 112.503 -0.239 . . . . 51.42 112.503 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 92.1 m -122.04 110.72 16.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.8 0.333 . . . . 73.34 111.168 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.836 ' HB1' HD21 ' A' ' 526' ' ' LEU . . . -94.6 142.6 27.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 70.42 111.069 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -133.89 108.92 8.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 72.41 110.899 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.58 ' OG1' HD23 ' A' ' 526' ' ' LEU . 2.5 m -93.96 119.19 32.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 72.51 111.185 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.426 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.3 pt? -131.3 156.55 45.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 74.15 110.93 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -106.17 150.07 26.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 71.52 110.839 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -157.31 171.69 19.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 51.32 111.088 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.24 160.6 56.57 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.653 0.739 . . . . 72.42 110.881 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 -15.23 36.72 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.663 2.242 . . . . 53.22 112.338 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -62.82 -50.74 69.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.219 -0.446 . . . . 72.43 110.872 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.36 148.64 6.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 43.32 111.112 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -137.32 172.97 12.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.484 . . . . 73.45 110.875 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.429 HG22 ' HE2' ' A' ' 525' ' ' PHE . 87.2 t -51.41 -50.01 29.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 64.14 111.1 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -53.27 -40.39 64.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 73.44 110.918 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.4 m -68.36 -41.4 80.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 53.21 111.106 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.668 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.6 mt -60.51 -51.24 70.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.243 -0.435 . . . . 72.12 110.921 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -64.73 -42.95 94.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 74.41 110.902 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -59.85 -38.05 81.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.466 . . . . 75.25 110.835 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 499' ' ' PHE . . . . . 0.522 ' HE1' HD22 ' A' ' 543' ' ' LEU . 9.4 t80 -72.04 -44.61 63.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 73.13 110.863 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 40.1 mt -57.02 -48.89 77.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.464 . . . . 72.13 110.939 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -71.5 -37.99 71.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 75.14 110.88 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -55.28 -49.19 72.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 64.03 110.868 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.35 -25.92 67.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.468 . . . . 61.34 110.939 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 112.44 -7.29 26.5 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.748 -0.739 . . . . 62.21 112.495 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.615 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.6 m-85 -71.45 160.31 82.95 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.656 0.741 . . . . 54.1 110.87 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 506' ' ' PRO . . . . . 0.514 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 54.0 Cg_endo -69.73 79.93 0.91 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.667 2.245 . . . . 65.35 112.368 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -95.81 -37.18 5.05 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.748 -0.739 . . . . 63.14 112.47 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 11.5 pttp -59.34 -43.62 92.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.771 0.319 . . . . 75.14 110.875 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -81.18 -33.31 33.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 73.25 110.846 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.595 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -54.87 169.64 0.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 61.22 111.107 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 34.0 t -127.11 110.83 23.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 74.43 111.144 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.668 HD13 ' HB3' ' A' ' 496' ' ' LEU . 56.5 mt -92.91 128.76 44.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 71.42 111.12 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.95 136.54 52.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 72.35 111.138 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -99.16 132.93 44.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 72.51 110.881 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 33.1 t -139.54 111.42 5.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 72.33 111.105 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.78 98.52 8.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 74.04 110.896 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.6 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -65.08 161.22 50.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.609 0.718 . . . . 74.21 111.112 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.6 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.72 71.13 1.52 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.699 2.266 . . . . 72.22 112.372 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.8 t 177.81 136.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 74.55 111.161 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -93.96 38.63 1.08 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 64.41 111.064 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -124.42 -35.28 2.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 73.44 111.092 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -139.85 177.26 8.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.277 -0.42 . . . . 74.54 110.906 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.45 152.65 44.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 63.54 110.911 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 524' ' ' GLU . . . . . 0.41 ' HG2' HD12 ' A' ' 553' ' ' LEU . 9.7 mt-10 -111.67 130.97 55.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 75.34 110.876 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.429 ' HE2' HG22 ' A' ' 493' ' ' VAL . 6.0 m-85 -132.93 135.41 45.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 71.2 110.87 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.836 HD21 ' HB1' ' A' ' 482' ' ' ALA . 2.6 tm? -103.92 112.22 25.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 64.3 110.893 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.796 HG12 HD21 ' A' ' 529' ' ' LEU . 14.5 t -95.28 111.08 25.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 71.3 111.141 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.474 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 14.1 tttm -87.76 115.18 25.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 72.12 110.904 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.796 HD21 HG12 ' A' ' 527' ' ' VAL . 6.1 mt -131.78 154.88 81.92 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.644 0.735 . . . . 73.21 110.899 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 530' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 529' ' ' LEU . 53.9 Cg_endo -69.71 162.73 40.92 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.707 2.271 . . . . 65.31 112.379 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 103.91 1.23 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.698 2.266 . . . . 70.35 112.392 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.0 mt -107.22 -170.96 1.79 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 73.51 110.935 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.3 t -71.83 150.43 44.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 64.12 110.874 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -48.92 64.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 64.54 110.904 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -60.55 -48.41 81.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.888 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 49.4 mmm-85 -54.47 -57.96 9.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 62.31 110.885 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -52.86 -52.58 56.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 62.34 110.908 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mt -56.36 -37.12 69.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 64.0 110.928 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -64.84 -46.16 83.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 64.23 110.872 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.615 HD22 ' CD2' ' A' ' 505' ' ' PHE . 24.9 tp -60.91 -51.13 70.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 74.14 110.907 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.36 -50.33 73.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 64.44 110.857 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -58.0 -51.88 67.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.14 110.867 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 543' ' ' LEU . . . . . 0.522 HD22 ' HE1' ' A' ' 499' ' ' PHE . 2.6 tt -52.83 -44.78 66.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.229 -0.441 . . . . 74.01 110.88 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -60.05 -56.42 21.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 71.42 110.898 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.23 -13.14 59.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 73.13 111.103 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 23.2 t -79.63 -57.77 3.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 75.31 110.803 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -88.42 -52.12 5.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.093 -0.503 . . . . 73.21 110.874 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.82 -12.51 60.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.32 110.912 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt 57.09 23.39 8.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.185 -0.462 . . . . 63.21 110.924 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -68.65 176.93 2.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 64.2 111.071 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.7 m -145.09 110.96 5.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 63.11 111.098 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.5 t -54.14 135.11 16.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 64.13 111.1 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 553' ' ' LEU . . . . . 0.41 HD12 ' HG2' ' A' ' 524' ' ' GLU . 77.6 mt -120.79 -47.64 2.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 55.04 110.877 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 554' ' ' ALA . . . . . 0.546 ' HB3' ' HB ' ' A' ' 484' ' ' THR . . . -133.88 165.84 24.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 65.12 111.069 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 80.3 p -171.69 138.48 1.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 53.41 110.84 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.558 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 6.0 pt-20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.33 110.888 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 N-CA-C 112.476 -0.249 . . . . 60.14 112.476 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 94.4 m -128.72 110.26 12.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.746 0.308 . . . . 74.12 111.154 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.423 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -96.81 130.1 44.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 72.01 111.094 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -117.56 116.45 27.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.217 -0.447 . . . . 75.41 110.923 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -98.81 110.04 22.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 72.1 111.158 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.488 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.9 pt? -133.37 145.64 50.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 62.42 110.89 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -89.29 137.72 32.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 72.32 110.911 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 487' ' ' ALA . . . . . 0.575 ' HB3' ' CD2' ' A' ' 525' ' ' PHE . . . -133.27 167.09 21.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 74.23 111.097 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -65.35 160.61 57.32 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.667 0.746 . . . . 71.43 110.862 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -12.79 33.6 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 2.251 . . . . 51.02 112.334 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -81.78 -37.29 27.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 64.53 110.861 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 87.8 t -70.75 120.67 19.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 60.1 111.143 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -113.49 178.72 4.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 73.23 110.883 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 54.1 t -53.46 -48.66 57.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 70.23 111.146 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -51.88 -42.08 62.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 64.25 110.875 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 69.6 m -67.84 -39.97 83.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.476 . . . . 64.14 111.139 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.574 ' HB3' HD13 ' A' ' 512' ' ' ILE . 2.3 mt -61.87 -50.94 70.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 70.22 110.899 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -64.79 -42.21 95.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.459 . . . . 74.02 110.859 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -60.04 -40.51 89.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.43 110.885 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 499' ' ' PHE . . . . . 0.563 ' HE1' HD22 ' A' ' 543' ' ' LEU . 15.0 t80 -70.9 -43.27 68.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 63.34 110.871 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 34.1 mt -57.78 -49.52 76.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 72.12 110.881 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.79 -37.96 73.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 71.41 110.872 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -56.38 -49.18 75.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 71.11 110.865 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -24.52 65.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 72.53 110.914 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -16.88 20.23 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.755 -0.736 . . . . 53.51 112.491 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.539 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.9 m-85 -60.94 160.24 21.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.658 0.742 . . . . 64.12 110.876 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 506' ' ' PRO . . . . . 0.498 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 53.7 Cg_endo -69.73 86.42 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.724 2.283 . . . . 60.34 112.333 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -102.04 -30.54 5.69 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.747 -0.739 . . . . 72.22 112.452 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -63.94 -42.22 97.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.766 0.317 . . . . 50.41 110.871 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -85.53 -27.19 25.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 73.0 110.854 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.626 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -62.34 165.6 5.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 62.44 111.104 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.83 111.28 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 73.5 111.092 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.574 HD13 ' HB3' ' A' ' 496' ' ' LEU . 54.3 mt -92.8 139.5 17.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 73.44 111.128 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -135.47 143.68 45.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 73.03 111.122 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -99.3 143.23 29.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 74.31 110.883 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 76.8 t -139.01 115.11 9.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.452 . . . . 62.33 111.119 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -74.63 127.3 32.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 63.55 110.868 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.586 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -110.41 160.22 29.25 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.563 0.697 . . . . 70.53 111.135 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.586 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.9 Cg_endo -69.76 74.48 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.692 2.262 . . . . 60.45 112.356 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.576 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.0 t 179.17 141.58 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.462 . . . . 73.34 111.122 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -99.56 27.41 5.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 63.02 111.089 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.48 -35.02 3.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 43.22 111.068 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.576 ' O ' HG23 ' A' ' 519' ' ' THR . 13.1 m-85 -146.8 159.98 42.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.275 -0.421 . . . . 73.51 110.943 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 4.6 ptt180 -131.18 165.02 24.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.09 -0.505 . . . . 74.03 110.867 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -92.84 139.94 30.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 64.02 110.869 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.575 ' CD2' ' HB3' ' A' ' 487' ' ' ALA . 10.8 m-85 -128.83 122.86 31.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.486 . . . . 71.41 110.851 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.41 HD22 ' HA ' ' A' ' 526' ' ' LEU . 0.5 OUTLIER -102.31 105.54 16.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.104 -0.498 . . . . 64.41 110.916 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.54 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.4 t -96.82 133.52 37.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 63.25 111.084 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.492 ' O ' HD23 ' A' ' 529' ' ' LEU . 18.9 tttp -108.55 108.1 18.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 61.44 110.929 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.626 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.6 mt -131.17 154.44 81.99 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.577 0.703 . . . . 75.52 110.898 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.16 43.14 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.678 2.252 . . . . 72.51 112.383 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 113.92 3.53 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.637 2.224 . . . . 74.41 112.354 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 1.2 mt -115.37 -171.19 1.91 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 60.0 110.907 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.32 154.98 38.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 62.13 110.848 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 534' ' ' ASP . . . . . 0.497 ' N ' HH21 ' A' ' 537' ' ' ARG . 4.6 m-20 -51.67 -47.11 63.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.101 -0.5 . . . . 70.11 110.855 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -59.78 -50.17 74.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 71.23 110.863 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -50.88 -59.11 4.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 71.44 110.897 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 537' ' ' ARG . . . . . 0.497 HH21 ' N ' ' A' ' 534' ' ' ASP . 79.4 mtm180 -53.51 -52.51 59.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 72.31 110.864 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.38 -39.32 67.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 73.24 110.931 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -67.23 -47.34 71.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.467 . . . . 72.43 110.879 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.539 HD22 ' CD2' ' A' ' 505' ' ' PHE . 21.7 tp -60.01 -51.09 71.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.14 110.92 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -59.47 -48.33 82.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 73.3 110.939 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 23.8 mtp180 -60.13 -53.52 56.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 73.51 110.869 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 543' ' ' LEU . . . . . 0.563 HD22 ' HE1' ' A' ' 499' ' ' PHE . 4.0 tt -52.9 -44.03 66.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 74.34 110.902 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.39 -56.48 20.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 73.34 110.875 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.36 -13.2 60.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 72.53 111.103 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.52 -57.34 3.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 72.41 110.898 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -88.33 -52.24 5.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.495 . . . . 71.11 110.914 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.1 tp -67.88 -12.35 60.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 33.13 110.945 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt 57.44 23.22 8.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 71.55 110.893 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.99 179.44 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 63.2 111.113 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 61.5 m -139.67 110.99 7.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 43.22 111.188 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.41 114.52 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 74.11 111.145 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 12.2 mt -90.92 -51.66 5.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 74.44 110.856 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -162.0 174.21 13.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 34.35 111.092 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 90.7 p -163.06 148.43 11.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 74.31 110.887 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.423 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 11.6 pt-20 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 70.03 110.889 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.478 -0.249 . . . . 75.42 112.478 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 25.6 m -131.6 107.35 8.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.8 0.333 . . . . 73.22 111.162 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.595 ' HB3' ' CG ' ' A' ' 556' ' ' GLU . . . -95.0 115.15 27.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 74.03 111.084 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -104.69 113.03 26.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 74.42 110.93 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 5.2 m -94.87 110.09 22.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.129 -0.487 . . . . 65.4 111.127 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.458 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -134.41 143.28 47.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 70.35 110.939 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.415 ' HD3' HD11 ' A' ' 553' ' ' LEU . 24.3 mtp180 -90.21 142.15 28.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 74.42 110.834 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 487' ' ' ALA . . . . . 0.485 ' HB3' ' CD2' ' A' ' 525' ' ' PHE . . . -137.15 168.54 19.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.172 -0.467 . . . . 73.13 111.065 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -63.94 160.57 45.67 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.617 0.722 . . . . 64.02 110.908 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -14.12 35.49 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.666 2.244 . . . . 75.43 112.322 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -80.17 -37.33 33.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 71.41 110.904 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 63.9 t -69.2 125.64 27.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.453 . . . . 74.12 111.169 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -117.99 175.35 5.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 43.21 110.873 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 60.9 t -51.79 -48.9 37.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 74.34 111.114 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -52.0 -40.38 60.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 54.15 110.918 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 95.2 m -66.47 -43.23 86.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.134 -0.485 . . . . 72.4 111.111 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.646 ' CB ' HD13 ' A' ' 512' ' ' ILE . 7.2 mt -61.78 -51.04 69.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 64.34 110.924 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -65.02 -35.09 80.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 72.54 110.841 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 42.6 mtp180 -64.19 -45.09 89.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.244 -0.435 . . . . 74.31 110.859 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -71.15 -36.92 72.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 71.22 110.9 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.456 HD12 HD11 ' A' ' 512' ' ' ILE . 29.2 mt -62.11 -50.43 71.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 71.11 110.962 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -71.08 -37.87 72.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 70.24 110.873 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.09 -48.95 78.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 73.45 110.905 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -67.88 -24.05 65.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 72.55 110.865 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 113.91 -18.6 19.11 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.745 -0.741 . . . . 63.01 112.472 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.511 ' CD2' HD22 ' A' ' 540' ' ' LEU . 15.9 m-85 -60.74 160.24 20.92 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.684 0.754 . . . . 62.53 110.884 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 506' ' ' PRO . . . . . 0.462 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 53.8 Cg_endo -69.77 90.08 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.683 2.255 . . . . 61.2 112.362 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -104.95 -39.26 2.35 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.788 -0.72 . . . . 34.44 112.501 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 17.1 mtpp -57.25 -52.08 66.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.728 0.299 . . . . 75.25 110.883 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.14 -36.27 66.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.426 . . . . 71.42 110.893 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.636 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -54.14 167.06 0.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 65.24 111.1 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.72 111.12 24.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 63.31 111.163 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.646 HD13 ' CB ' ' A' ' 496' ' ' LEU . 74.7 mt -96.02 127.05 48.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 62.13 111.141 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 2.1 m -122.13 148.21 45.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 61.44 111.193 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -104.41 140.35 38.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 72.34 110.925 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 80.8 t -136.43 111.91 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 65.04 111.177 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.09 110.93 7.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 74.33 110.924 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -91.51 160.25 37.16 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.547 0.689 . . . . 61.31 111.104 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.561 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.6 Cg_endo -69.79 74.55 1.29 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.673 2.249 . . . . 74.22 112.346 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.62 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.9 t -177.04 137.37 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 73.32 111.149 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.42 25.8 4.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 55.41 111.101 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.38 -35.15 3.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 62.01 111.072 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.62 ' O ' HG23 ' A' ' 519' ' ' THR . 13.4 m-85 -144.58 166.77 24.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 72.2 110.906 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -136.32 160.23 39.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.492 . . . . 72.11 110.853 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -88.97 138.39 31.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 51.33 110.906 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.485 ' CD2' ' HB3' ' A' ' 487' ' ' ALA . 10.9 m-85 -128.76 122.2 30.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 54.14 110.881 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.5 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -99.3 104.82 16.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 74.22 110.905 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.578 HG12 HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.57 111.86 27.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 71.23 111.112 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.509 ' O ' HD23 ' A' ' 529' ' ' LEU . 17.3 ttmt -91.38 109.05 20.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.15 110.86 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.636 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.0 mt -132.53 154.42 81.52 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.618 0.723 . . . . 74.35 110.921 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 162.19 43.04 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.714 2.276 . . . . 72.52 112.349 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 103.88 1.23 Allowed 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.684 2.256 . . . . 74.02 112.344 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 5.0 mt -101.06 -171.34 1.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 74.21 110.884 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 30.0 t -71.12 151.25 44.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 72.31 110.875 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -51.75 -51.14 58.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 63.02 110.873 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -61.14 -45.41 94.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.436 . . . . 71.3 110.924 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 11.6 mmt180 -57.38 -58.07 9.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 64.14 110.87 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -52.82 -52.15 58.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 72.31 110.908 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.4 mt -56.86 -48.12 78.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 71.43 110.9 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.8 -41.63 74.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 72.3 110.908 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.511 HD22 ' CD2' ' A' ' 505' ' ' PHE . 34.5 tp -66.38 -39.71 89.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.136 -0.484 . . . . 64.23 110.904 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -61.23 -55.4 32.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 74.45 110.836 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 1.6 ptt85 -59.07 -47.83 83.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 75.22 110.849 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 5.5 tt -53.59 -47.34 70.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.439 . . . . 75.41 110.898 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -60.63 -56.04 26.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 73.11 110.867 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.48 -14.09 55.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 63.03 111.138 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.03 -59.28 2.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 75.43 110.798 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -86.23 -52.55 5.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 74.43 110.87 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.44 HD23 ' HB2' ' A' ' 550' ' ' ALA . 1.2 tp -67.53 -12.67 60.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.456 . . . . 61.04 110.93 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.27 23.2 8.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 72.13 110.9 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 550' ' ' ALA . . . . . 0.44 ' HB2' HD23 ' A' ' 548' ' ' LEU . . . -68.68 175.4 3.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 71.41 111.075 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 88.9 m -137.55 111.18 8.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 64.51 111.148 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.2 111.81 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 73.44 111.167 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 553' ' ' LEU . . . . . 0.415 HD11 ' HD3' ' A' ' 486' ' ' ARG . 12.1 mt -90.15 -51.96 5.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 54.55 110.881 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.4 175.12 13.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 74.15 111.09 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 91.9 p -163.72 139.34 6.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 64.23 110.837 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.595 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 3.7 pt-20 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 62.15 110.843 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.498 -0.241 . . . . 52.33 112.498 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 1.6 m -123.94 109.21 13.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.776 0.322 . . . . 74.54 111.175 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 482' ' ' ALA . . . . . 0.74 ' HB3' ' CG ' ' A' ' 556' ' ' GLU . . . -94.87 121.98 37.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 32.43 111.103 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -115.95 114.6 24.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.439 . . . . 72.31 110.934 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.482 HG23 ' CD2' ' A' ' 526' ' ' LEU . 1.2 m -100.06 113.55 26.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.095 -0.502 . . . . 75.41 111.158 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.491 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -131.64 143.86 50.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 75.34 110.861 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -92.14 145.25 24.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.467 . . . . 71.14 110.846 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -148.66 169.76 19.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 72.42 111.139 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -64.97 160.8 52.97 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.657 0.741 . . . . 74.34 110.925 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -10.74 29.3 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.691 2.261 . . . . 74.45 112.385 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -73.85 -46.45 44.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 71.54 110.853 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 491' ' ' VAL . . . . . 0.631 HG11 HD21 ' A' ' 548' ' ' LEU . 67.0 t -66.92 138.86 22.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.11 111.121 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -133.73 179.71 6.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 64.2 110.903 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.6 t -51.54 -47.93 36.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 71.32 111.093 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -51.65 -39.99 59.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.4 110.879 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.2 m -71.31 -35.53 71.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 64.54 111.141 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.66 ' CB ' HD13 ' A' ' 512' ' ' ILE . 4.1 mt -67.32 -45.57 76.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 71.22 110.898 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -69.47 -46.26 67.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 74.22 110.898 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -64.12 -32.47 74.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 73.32 110.891 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -73.28 -46.99 46.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 72.12 110.85 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 43.4 mt -61.08 -42.53 98.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 75.03 110.941 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -73.05 -37.59 66.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 60.55 110.891 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -60.34 -48.98 79.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 72.4 110.88 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 503' ' ' LYS . . . . . 0.596 ' HE2' HD13 ' A' ' 543' ' ' LEU . 28.8 mmmt -68.97 -23.78 64.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 72.34 110.875 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.12 -17.6 19.41 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.746 -0.74 . . . . 70.45 112.493 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -63.05 160.16 41.11 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.593 0.711 . . . . 71.25 110.943 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 95.57 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 122.689 2.259 . . . . 64.21 112.325 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -111.15 -37.24 1.68 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.695 -0.764 . . . . 52.43 112.482 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -63.34 -42.56 98.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.791 0.329 . . . . 64.43 110.874 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -79.91 -38.43 32.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 73.42 110.938 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.624 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -55.94 171.44 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 73.43 111.115 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 56.4 t -127.08 118.08 49.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.272 -0.422 . . . . 62.43 111.159 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.66 HD13 ' CB ' ' A' ' 496' ' ' LEU . 50.7 mt -96.82 141.84 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 74.33 111.151 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.89 138.72 37.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.13 111.173 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.53 143.17 27.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 53.11 110.956 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 83.7 t -135.77 104.61 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 75.23 111.11 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 18.9 tm0? -73.84 102.08 3.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 65.4 110.894 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -81.92 160.23 63.98 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.595 0.712 . . . . 75.12 111.089 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.78 74.55 1.29 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.629 2.22 . . . . 71.24 112.356 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 4.4 t -175.05 139.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 72.23 111.187 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.63 25.18 6.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 71.13 111.083 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.85 -34.57 3.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 42.21 111.11 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -138.6 177.61 7.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.242 -0.435 . . . . 74.21 110.944 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 44.2 mtt85 -144.78 153.66 41.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 75.51 110.875 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 524' ' ' GLU . . . . . 0.415 ' HG2' HD12 ' A' ' 553' ' ' LEU . 9.8 mt-10 -92.27 138.74 31.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 64.04 110.878 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.474 ' CD1' HD11 ' A' ' 496' ' ' LEU . 9.6 m-85 -122.25 122.77 39.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.138 -0.483 . . . . 70.33 110.868 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.482 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -100.46 101.48 12.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 71.0 110.944 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.565 ' CG1' HD21 ' A' ' 529' ' ' LEU . 19.7 t -95.98 122.7 47.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 55.01 111.128 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.531 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 0.1 OUTLIER -100.63 109.65 21.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.478 . . . . 73.32 110.874 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.624 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -130.77 154.65 81.9 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.583 0.706 . . . . 75.35 110.915 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 162.41 42.18 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.66 2.24 . . . . 62.04 112.379 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 104.04 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.667 2.245 . . . . 73.42 112.346 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.6 mt -103.0 -171.0 1.87 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 65.31 110.895 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 21.3 m -75.69 152.59 37.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 62.0 110.853 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.64 -46.77 63.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 75.24 110.918 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.03 -43.1 99.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 73.24 110.915 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -62.0 -55.8 25.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 75.34 110.877 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 45.9 mtp180 -52.79 -53.15 52.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 70.15 110.895 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 538' ' ' LEU . . . . . 0.567 HD22 HH21 ' A' ' 542' ' ' ARG . 0.8 OUTLIER -55.38 -48.3 74.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 73.53 110.975 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -55.55 -41.84 73.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.23 110.948 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 30.4 tp -66.0 -39.2 90.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.082 -0.508 . . . . 74.42 110.901 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -61.74 -55.63 28.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.185 -0.461 . . . . 75.41 110.919 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 542' ' ' ARG . . . . . 0.567 HH21 HD22 ' A' ' 538' ' ' LEU . 17.2 ptp180 -58.55 -47.95 82.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.096 -0.502 . . . . 64.1 110.89 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 543' ' ' LEU . . . . . 0.596 HD13 ' HE2' ' A' ' 503' ' ' LYS . 12.2 mt -53.72 -47.92 70.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.24 110.945 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -59.62 -56.26 24.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.166 -0.47 . . . . 74.22 110.877 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.06 -13.54 58.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 73.24 111.082 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -59.03 2.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.889 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -88.2 -52.22 5.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 70.03 110.896 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 548' ' ' LEU . . . . . 0.631 HD21 HG11 ' A' ' 491' ' ' VAL . 0.1 OUTLIER -67.63 -12.73 61.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 73.55 110.991 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt 55.89 24.22 7.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 50.01 110.942 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.81 -179.94 3.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.232 -0.44 . . . . 72.33 111.104 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.7 m -145.05 111.37 5.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 72.22 111.096 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.5 t -52.08 120.23 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 65.02 111.138 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 553' ' ' LEU . . . . . 0.415 HD12 ' HG2' ' A' ' 524' ' ' GLU . 16.0 mt -99.0 -50.91 4.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 72.2 110.88 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -159.11 174.71 14.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.447 . . . . 72.35 111.131 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 51.1 p -161.04 163.51 31.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 63.0 110.857 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 556' ' ' GLU . . . . . 0.74 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 18.5 pt-20 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 73.22 110.88 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.471 -0.251 . . . . 54.35 112.471 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 9.3 m -125.17 113.65 17.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.811 0.339 . . . . 52.33 111.133 -179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.06 121.18 36.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 65.12 111.096 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -114.01 110.18 19.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 70.31 110.921 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 484' ' ' THR . . . . . 0.488 HG23 HD22 ' A' ' 526' ' ' LEU . 1.5 m -97.77 120.21 37.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 64.15 111.123 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 485' ' ' LEU . . . . . 0.468 ' H ' HD23 ' A' ' 485' ' ' LEU . 2.1 pt? -136.96 153.2 50.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 55.14 110.888 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 486' ' ' ARG . . . . . 0.529 ' HB2' HD11 ' A' ' 553' ' ' LEU . 2.5 ttm180 -98.89 137.87 36.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.454 . . . . 63.44 110.864 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 487' ' ' ALA . . . . . 0.705 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -146.52 168.06 22.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 63.33 111.104 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.56 160.75 49.76 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.608 0.718 . . . . 63.24 110.9 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -15.86 37.08 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.653 2.235 . . . . 75.4 112.322 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -66.64 -47.48 72.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 74.03 110.847 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 38.7 t -67.87 129.63 32.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 64.33 111.123 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -122.6 177.77 5.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 72.23 110.844 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.582 HG13 ' HB ' ' A' ' 512' ' ' ILE . 87.1 t -51.5 -49.53 32.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 73.22 111.132 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -50.78 -40.36 54.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 73.53 110.841 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 91.5 m -70.57 -35.14 72.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 73.24 111.137 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 496' ' ' LEU . . . . . 0.514 ' CB ' HD13 ' A' ' 512' ' ' ILE . 4.5 mt -68.02 -44.19 77.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 73.01 110.887 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -69.39 -45.04 70.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 65.45 110.916 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -66.48 -32.78 74.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 74.44 110.876 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -73.6 -42.67 61.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.916 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 52.9 mt -65.53 -41.56 92.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 70.14 110.934 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -73.07 -37.76 66.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.13 110.88 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -64.02 -46.32 84.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 74.53 110.877 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -65.88 -24.76 66.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 73.22 110.941 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.01 -16.06 20.73 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.717 -0.754 . . . . 74.22 112.487 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 505' ' ' PHE . . . . . 0.416 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.2 m-85 -71.94 160.27 83.15 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.66 0.743 . . . . 73.52 110.877 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 98.44 0.69 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.676 2.25 . . . . 51.34 112.313 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -116.27 -34.59 1.31 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.779 -0.724 . . . . 43.32 112.495 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 3.7 mtmp? -62.39 -50.56 71.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.779 0.323 . . . . 72.35 110.907 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -73.02 -32.85 65.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 73.32 110.897 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 510' ' ' ALA . . . . . 0.618 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -59.75 172.94 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.138 -0.483 . . . . 51.41 111.097 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.03 119.37 52.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.225 -0.443 . . . . 74.23 111.145 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.582 ' HB ' HG13 ' A' ' 493' ' ' VAL . 44.2 mt -99.28 141.9 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 74.44 111.141 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.06 134.3 36.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 75.32 111.128 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 12.5 pm0 -94.89 142.74 27.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 72.2 110.949 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.8 t -138.21 114.33 10.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 74.34 111.183 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.08 113.01 10.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 75.1 110.88 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 517' ' ' ALA . . . . . 0.577 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -91.76 160.34 36.43 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.616 0.722 . . . . 54.44 111.055 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 518' ' ' PRO . . . . . 0.577 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.9 Cg_endo -69.75 74.43 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.673 2.249 . . . . 75.53 112.375 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 519' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 522' ' ' TYR . 3.0 t -179.32 141.02 0.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 72.45 111.145 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -97.33 24.76 6.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.253 -0.431 . . . . 44.44 111.125 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.63 -35.67 2.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 64.42 111.041 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 522' ' ' TYR . . . . . 0.56 ' O ' HG23 ' A' ' 519' ' ' THR . 7.4 m-85 -137.58 168.14 20.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 74.21 110.887 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 10.6 mmt85 -140.67 160.03 40.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.094 -0.503 . . . . 63.12 110.884 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -90.52 139.48 30.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 64.41 110.89 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 525' ' ' PHE . . . . . 0.705 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 89.9 m-85 -128.47 124.63 36.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.486 . . . . 61.21 110.859 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 526' ' ' LEU . . . . . 0.488 HD22 HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -106.35 104.31 13.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.465 . . . . 71.14 110.907 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.547 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.2 t -96.86 127.04 49.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 65.51 111.154 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 528' ' ' LYS . . . . . 0.592 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 3.1 tmtm? -106.44 108.32 19.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 54.21 110.885 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 529' ' ' LEU . . . . . 0.618 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.3 mt -130.58 154.73 81.76 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.631 0.729 . . . . 43.34 110.873 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 162.39 42.28 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.675 2.25 . . . . 65.44 112.331 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 104.05 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.701 2.267 . . . . 51.11 112.337 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.7 mt -103.78 -170.9 1.84 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 63.12 110.961 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 32.5 t -72.98 151.09 41.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 51.33 110.865 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.06 -46.31 65.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 44.31 110.82 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -61.11 -53.55 55.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 55.35 110.888 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 42.2 mmt180 -52.04 -55.79 18.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.458 . . . . 75.22 110.885 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 -52.93 -53.2 52.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 65.03 110.878 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.2 -39.8 70.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 74.14 110.933 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -64.21 -42.17 96.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.48 . . . . 74.54 110.885 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 540' ' ' LEU . . . . . 0.416 HD22 ' CD2' ' A' ' 505' ' ' PHE . 22.7 tp -64.01 -51.17 65.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 70.05 110.871 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 541' ' ' GLU . . . . . 0.434 ' OE1' HG22 ' A' ' 552' ' ' VAL . 62.6 mm-40 -57.28 -50.79 71.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 74.3 110.872 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -57.92 -52.52 65.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 74.33 110.881 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.5 mt -52.75 -43.5 65.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 72.12 110.925 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -60.86 -56.6 19.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 73.52 110.858 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.09 -13.45 60.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 74.22 111.091 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.7 -57.78 3.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.217 -0.447 . . . . 72.43 110.89 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -88.41 -52.32 5.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 62.41 110.863 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.71 -12.67 61.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 74.33 110.913 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 57.04 23.33 8.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 75.02 110.915 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -69.32 179.68 1.92 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 71.42 111.119 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 3.0 m -144.09 110.94 5.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 75.53 111.13 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 552' ' ' VAL . . . . . 0.434 HG22 ' OE1' ' A' ' 541' ' ' GLU . 39.2 t -53.64 115.59 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 65.23 111.092 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 553' ' ' LEU . . . . . 0.529 HD11 ' HB2' ' A' ' 486' ' ' ARG . 72.1 mt -92.51 -45.7 8.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 74.25 110.955 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.11 174.58 12.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 71.42 111.087 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 63.7 p -169.05 149.85 4.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 71.22 110.852 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 75.51 110.91 -179.986 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 22.3 mtp . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.814 0.34 . . . . 71.21 110.893 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 7.2 p -159.68 135.85 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 73.34 111.115 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -109.38 172.4 16.1 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.706 -0.759 . . . . 64.22 112.469 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -133.12 145.95 51.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.895 0.379 . . . . 73.54 110.861 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -139.65 153.55 47.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 74.35 110.918 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -99.84 127.01 46.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 74.22 110.92 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 3.7 m -128.14 177.09 7.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 63.31 110.871 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 59.7 mt -101.45 142.14 16.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 73.15 111.085 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -161.95 115.71 1.86 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 74.41 110.886 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -57.94 -27.86 63.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 62.14 110.894 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -86.47 171.63 10.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 75.02 111.146 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 164.24 99.01 0.13 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.755 -0.736 . . . . 64.23 112.544 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -143.23 136.45 7.02 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.768 -0.73 . . . . 70.23 112.518 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' THR . . . . . 0.46 ' OG1' HG23 ' A' ' 557' ' ' THR . 82.1 m -129.34 110.61 12.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.802 0.334 . . . . 73.14 111.175 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.671 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -97.38 112.19 24.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 72.52 111.138 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -101.29 118.59 37.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 71.05 110.93 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.471 HG23 ' CD2' ' A' ' 526' ' ' LEU . 1.0 OUTLIER -101.44 112.84 25.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 65.11 111.149 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.484 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -132.6 142.91 49.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.256 -0.429 . . . . 61.5 110.922 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.42 146.02 24.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 70.1 110.875 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 487' ' ' ALA . . . . . 0.726 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -151.35 167.35 28.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 61.23 111.091 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -61.04 160.48 21.11 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.623 0.725 . . . . 73.33 110.875 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -23.61 30.6 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.689 2.259 . . . . 63.35 112.317 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 32.9 m-20 -63.56 -35.06 79.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 72.31 110.916 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 46.5 t -73.81 132.94 32.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.475 . . . . 75.21 111.136 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -127.88 177.67 6.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 74.34 110.879 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 91.1 t -51.72 -42.14 30.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 72.31 111.119 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -58.54 -41.21 85.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 73.54 110.892 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 34.8 m -66.31 -44.49 83.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 74.24 111.132 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.608 ' HB3' HD13 ' A' ' 512' ' ' ILE . 7.4 mt -62.03 -51.0 69.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 75.14 110.914 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -64.32 -34.83 79.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 75.0 110.858 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -64.71 -46.38 82.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 73.41 110.89 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -70.27 -35.41 73.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 72.43 110.839 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.714 HD12 HD11 ' A' ' 512' ' ' ILE . 36.4 mt -63.61 -52.81 59.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 74.32 110.922 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.78 -37.96 79.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 71.51 110.919 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -59.32 -48.27 82.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.487 . . . . 74.11 110.902 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -66.66 -24.85 66.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 73.11 110.897 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -18.35 18.99 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.74 -0.743 . . . . 75.25 112.505 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.505 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.8 m-85 -62.21 160.25 32.95 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.657 0.741 . . . . 75.34 110.894 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 90.3 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.653 2.235 . . . . 74.22 112.335 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -107.46 -26.08 5.79 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.702 -0.761 . . . . 61.12 112.478 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -68.05 -51.94 41.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 71.15 110.891 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -75.22 -33.9 61.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 61.32 110.867 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.625 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -55.92 170.56 0.29 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 31.53 111.093 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.01 113.35 32.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.232 -0.44 . . . . 73.44 111.101 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.714 HD11 HD12 ' A' ' 500' ' ' LEU . 57.9 mt -100.05 126.74 53.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 73.3 111.128 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -125.03 148.7 48.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 74.04 111.181 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -101.25 143.63 31.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 60.31 110.878 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 90.2 t -133.07 103.62 6.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 75.43 111.133 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -68.51 99.22 0.94 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 75.24 110.916 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.573 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -76.58 160.19 77.74 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.697 . . . . 74.53 111.07 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.573 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.74 74.5 1.27 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.696 2.264 . . . . 65.24 112.369 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 4.7 t -177.68 138.88 0.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.201 -0.454 . . . . 64.12 111.157 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.73 26.14 4.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.252 -0.431 . . . . 63.12 111.087 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.86 -35.23 3.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 71.53 111.13 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -141.08 177.15 8.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 74.43 110.914 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -147.76 154.01 39.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.072 -0.513 . . . . 75.25 110.847 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -89.02 145.94 25.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 71.33 110.936 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.726 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 96.3 m-85 -129.87 124.34 32.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 72.42 110.919 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.471 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.4 OUTLIER -102.64 105.87 16.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 63.04 110.906 -179.961 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.522 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.26 125.66 49.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 70.22 111.161 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.547 ' O ' HD23 ' A' ' 529' ' ' LEU . 6.0 ttmm -104.63 107.18 18.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 74.43 110.895 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.625 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.1 mt -132.3 154.54 81.64 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 73.04 110.897 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 162.08 43.48 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.686 2.257 . . . . 71.2 112.315 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 104.36 1.31 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.669 2.246 . . . . 44.41 112.338 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.0 mt -105.32 -171.07 1.85 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 70.14 110.944 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 9.3 t -72.35 153.12 41.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 73.52 110.883 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -52.08 -44.46 64.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 70.43 110.88 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -60.48 -38.97 85.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.246 -0.434 . . . . 65.2 110.933 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -66.05 -53.22 41.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 73.4 110.856 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 -55.52 -45.54 77.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 61.14 110.868 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mt -69.06 -38.88 79.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 64.02 110.957 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -63.75 -47.03 82.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 54.03 110.908 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.505 HD22 ' CD2' ' A' ' 505' ' ' PHE . 26.1 tp -66.1 -51.14 60.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 71.3 110.945 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -58.23 -49.78 75.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 75.2 110.913 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 8.3 mmt85 -58.39 -53.5 57.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 71.22 110.881 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 10.3 mt -52.7 -43.72 65.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.215 -0.448 . . . . 64.2 110.895 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.3 -56.48 21.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 73.22 110.889 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.46 -13.31 60.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 61.14 111.115 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 22.5 t -79.51 -56.97 3.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.894 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -88.38 -52.18 5.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 72.23 110.902 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.3 tp -67.86 -12.37 60.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.161 -0.472 . . . . 74.13 110.909 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 57.63 23.38 9.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.22 -0.445 . . . . 65.32 110.852 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -65.08 179.84 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 74.2 111.114 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 19.4 m -145.13 110.94 5.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 75.42 111.142 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.4 t -59.01 108.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 72.33 111.135 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 63.8 mt -89.71 -42.23 11.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 64.53 110.898 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -158.55 175.08 14.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 75.13 111.112 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 95.2 p -171.98 145.87 1.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 71.43 110.869 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.671 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 10.6 pt-20 -137.98 147.47 44.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.1 110.861 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 557' ' ' THR . . . . . 0.46 HG23 ' OG1' ' A' ' 481' ' ' THR . 32.2 m -139.43 142.37 37.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 64.24 111.095 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 23.3 t -105.85 100.84 11.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 63.34 111.162 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 C-N-CA 120.729 -0.748 . . . . 74.0 112.514 179.997 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 11.6 ttt . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.856 0.36 . . . . 61.12 110.877 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 60.0 t -90.07 -57.31 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.19 -0.459 . . . . 72.24 111.108 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 176.4 169.59 38.02 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.707 -0.758 . . . . 72.01 112.473 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -106.98 -179.77 4.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.857 0.36 . . . . 71.03 110.884 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -133.45 145.95 50.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.142 -0.481 . . . . 74.2 110.899 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -121.15 27.09 8.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 74.15 110.884 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 1.4 t -95.0 177.24 5.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.476 . . . . 62.2 110.851 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 24.2 pt -70.17 178.45 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 64.03 111.127 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -125.47 79.7 1.83 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.169 -0.469 . . . . 73.43 110.878 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -172.24 139.56 1.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.848 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 4.6 m -95.59 144.6 25.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.153 -0.476 . . . . 73.14 111.135 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -155.93 -115.81 0.52 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.75 -0.738 . . . . 52.53 112.516 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 156.01 145.22 4.13 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.7 -0.762 . . . . 41.12 112.446 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 21.2 m -124.86 107.5 10.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.794 0.33 . . . . 62.12 111.161 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.732 ' HB3' ' CG ' ' A' ' 556' ' ' GLU . . . -94.98 114.09 25.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 52.25 111.083 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -106.1 117.38 33.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 62.2 110.965 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.474 HG23 HD22 ' A' ' 526' ' ' LEU . 0.6 OUTLIER -103.34 113.6 27.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 60.35 111.143 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.494 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.9 pt? -129.14 142.38 50.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 74.42 110.909 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -90.3 130.56 36.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 74.31 110.833 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' ALA . . . . . 0.659 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -133.94 169.42 17.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 74.13 111.127 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -60.49 160.55 17.88 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.652 0.739 . . . . 64.21 110.919 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -20.63 34.31 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.721 2.28 . . . . 72.01 112.302 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -67.97 -43.56 78.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 73.44 110.926 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.644 HG11 HD21 ' A' ' 548' ' ' LEU . 61.4 t -64.01 133.01 29.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.147 -0.479 . . . . 73.02 111.149 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -124.58 176.88 6.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 64.24 110.906 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 96.4 t -53.57 -50.02 52.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 75.23 111.108 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -52.05 -37.14 52.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 74.14 110.901 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 93.5 m -69.61 -41.83 75.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 64.21 111.188 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.64 ' CB ' HD13 ' A' ' 512' ' ' ILE . 8.0 mt -63.51 -49.83 72.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 75.3 110.956 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -65.87 -40.13 91.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 73.51 110.906 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -61.08 -45.48 94.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 74.52 110.878 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -69.5 -39.51 77.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 64.22 110.891 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.606 HD12 HD11 ' A' ' 512' ' ' ILE . 36.7 mt -58.86 -52.71 64.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 64.32 110.915 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -69.19 -37.96 78.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 75.44 110.873 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -56.18 -47.42 78.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 71.12 110.9 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -70.56 -22.71 62.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 71.54 110.913 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -17.86 19.43 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.739 -0.744 . . . . 53.21 112.519 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.75 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.3 m-85 -61.3 160.22 25.06 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.614 0.721 . . . . 74.33 110.883 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 93.2 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.671 2.247 . . . . 74.03 112.34 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.1 -38.12 1.28 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.699 -0.762 . . . . 64.14 112.434 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 7.9 pttt -60.53 -30.74 69.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.776 0.322 . . . . 51.2 110.906 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -95.52 -32.79 12.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.194 -0.457 . . . . 74.13 110.92 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.606 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -57.28 170.67 0.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 73.33 111.114 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 22.0 t -126.9 111.53 26.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 64.14 111.141 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.64 HD13 ' CB ' ' A' ' 496' ' ' LEU . 72.6 mt -100.53 137.48 27.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 65.43 111.108 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.76 138.48 39.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 74.12 111.118 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 6.1 tt0 -83.96 140.48 31.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 53.21 110.893 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 67.6 t -131.82 100.38 4.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.192 -0.458 . . . . 72.3 111.125 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -67.53 112.1 4.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 54.11 110.915 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.582 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -94.51 160.26 31.99 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.619 0.723 . . . . 64.25 111.091 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.582 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.78 74.52 1.29 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.672 2.248 . . . . 72.23 112.374 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.631 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.0 t -176.43 137.48 0.28 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 62.53 111.096 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.4 25.15 4.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 61.12 111.087 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.99 -35.4 3.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 63.43 111.055 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.631 ' O ' HG23 ' A' ' 519' ' ' THR . 12.7 m-85 -143.16 170.89 14.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 71.44 110.874 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 60.5 mtt-85 -142.67 160.32 40.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 74.04 110.869 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -91.29 141.99 28.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 73.1 110.887 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.659 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 80.7 m-85 -127.86 120.31 27.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 71.34 110.867 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.474 HD22 HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -96.39 106.22 18.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 70.53 110.935 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.546 ' CG1' HD21 ' A' ' 529' ' ' LEU . 20.0 t -100.93 118.07 47.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 64.51 111.129 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.524 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 0.5 OUTLIER -96.6 107.45 19.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 74.25 110.91 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.606 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.3 mt -130.33 154.38 81.47 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.563 0.696 . . . . 61.52 110.93 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 162.15 43.2 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.675 2.25 . . . . 72.04 112.327 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 117.19 4.94 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.695 2.264 . . . . 61.25 112.299 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 2.5 mt -118.83 -170.96 2.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 74.23 110.91 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.1 t -67.23 148.16 52.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 74.2 110.844 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -51.91 -48.02 64.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 71.01 110.85 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -61.95 -44.53 96.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 62.53 110.86 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -61.07 -54.04 49.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.483 . . . . 73.12 110.903 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -54.14 -53.05 58.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.253 -0.431 . . . . 54.52 110.838 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -60.42 -40.0 89.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 70.33 110.902 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -63.25 -48.82 76.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 71.12 110.88 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.75 HD22 ' CD2' ' A' ' 505' ' ' PHE . 49.1 tp -59.01 -51.04 71.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 62.31 110.937 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -56.37 -48.81 76.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 74.34 110.892 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -63.82 -37.93 89.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 72.12 110.833 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 4.8 tt -60.27 -50.95 71.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 74.41 110.921 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 544' ' ' PHE . . . . . 0.508 ' CE2' HD11 ' A' ' 540' ' ' LEU . 12.2 m-85 -63.35 -50.56 69.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 72.34 110.837 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.504 ' HA ' ' HB3' ' A' ' 550' ' ' ALA . . . -61.12 -27.49 68.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 70.04 111.066 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.7 t -80.71 -62.73 1.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.253 -0.431 . . . . 64.41 110.818 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -64.62 -59.44 4.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 54.41 110.88 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.644 HD21 HG11 ' A' ' 491' ' ' VAL . 1.7 tp -68.93 -8.58 45.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.138 -0.483 . . . . 74.1 110.941 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.71 22.56 11.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 75.42 110.901 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 550' ' ' ALA . . . . . 0.504 ' HB3' ' HA ' ' A' ' 545' ' ' ALA . . . -73.84 179.6 4.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 50.31 111.091 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.5 m -145.05 110.95 5.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 55.53 111.101 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 46.9 t -52.11 112.48 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 53.42 111.131 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 13.4 mt -88.58 -51.95 5.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.149 -0.478 . . . . 42.34 110.932 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.55 173.78 15.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 75.33 111.047 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 95.2 p -160.7 145.41 14.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 63.41 110.84 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.732 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 9.4 pt-20 -139.72 148.97 43.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.124 -0.489 . . . . 51.31 110.911 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 26.7 m -142.06 141.66 32.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 60.24 111.107 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 37.3 t -88.09 105.68 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 51.13 111.165 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 C-N-CA 120.714 -0.755 . . . . 24.22 112.492 -179.993 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.807 0.336 . . . . 72.33 110.864 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 36.0 m -83.2 -25.28 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 71.34 111.134 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 71.72 -126.02 12.02 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.748 -0.739 . . . . 75.33 112.491 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -140.32 -179.62 6.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.866 0.365 . . . . 71.04 110.883 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -109.72 -40.71 4.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 73.52 110.862 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 53.5 p90 -159.42 146.95 17.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.203 -0.453 . . . . 74.3 110.949 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 1.8 t -136.18 159.59 41.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 63.41 110.828 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 66.1 mt -103.12 140.9 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 64.34 111.168 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -117.73 60.67 0.77 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 60.15 110.825 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -163.11 148.7 11.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 74.21 110.923 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -130.6 141.54 50.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.119 -0.491 . . . . 74.1 111.122 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -139.8 -50.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.705 -0.76 . . . . 55.14 112.446 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 112.18 159.27 14.66 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 51.01 112.461 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 20.1 m -128.91 109.35 11.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.751 0.31 . . . . 74.41 111.139 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -96.0 123.98 39.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 64.0 111.111 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -115.05 111.29 20.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.213 -0.449 . . . . 75.55 110.921 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.81 113.97 25.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.109 -0.496 . . . . 45.13 111.138 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.507 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.9 pt? -130.28 143.09 50.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 60.34 110.924 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.603 ' HB2' HD21 ' A' ' 553' ' ' LEU . 10.8 ttt180 -86.99 141.38 28.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 72.0 110.885 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 487' ' ' ALA . . . . . 0.738 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -149.47 160.64 43.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 64.34 111.137 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 488' ' ' GLU . . . . . 0.643 ' HG2' HG23 ' A' ' 491' ' ' VAL . 1.6 pm0 -51.72 156.85 2.16 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.658 0.742 . . . . 75.33 110.894 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 -9.24 25.63 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.712 2.275 . . . . 74.22 112.375 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -77.87 -44.66 26.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 71.5 110.918 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.643 HG23 ' HG2' ' A' ' 488' ' ' GLU . 97.4 t -56.34 124.29 9.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 74.52 111.153 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -116.67 171.41 7.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 70.24 110.898 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 91.5 t -51.71 -49.52 34.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 72.43 111.101 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -53.02 -40.17 63.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 72.43 110.932 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 89.5 m -66.91 -45.43 77.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 71.44 111.182 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.485 ' CB ' HD13 ' A' ' 512' ' ' ILE . 8.7 mt -61.58 -51.08 70.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.205 -0.452 . . . . 63.23 110.923 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 497' ' ' ARG . . . . . 0.488 ' HB3' HD12 ' A' ' 512' ' ' ILE . 9.4 ptm180 -63.5 -37.0 85.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 63.35 110.863 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 29.5 mtt85 -63.75 -44.29 93.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 73.25 110.895 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -70.25 -36.62 74.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 75.4 110.895 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.525 HD12 HD11 ' A' ' 512' ' ' ILE . 38.4 mt -63.04 -53.05 59.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 61.54 110.92 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -67.97 -38.36 82.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 72.3 110.88 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -58.52 -48.56 80.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.3 110.914 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -65.89 -25.07 67.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 71.42 110.896 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.04 -17.88 19.38 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.754 -0.736 . . . . 43.31 112.464 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.793 ' CD2' HD22 ' A' ' 540' ' ' LEU . 18.4 m-85 -62.18 160.21 32.96 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.65 0.738 . . . . 71.43 110.891 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 506' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 53.5 Cg_endo -69.75 88.29 0.54 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.691 2.261 . . . . 62.25 112.337 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -104.64 -28.36 5.71 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.783 -0.722 . . . . 55.11 112.513 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt -64.91 -52.02 58.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.744 0.307 . . . . 74.3 110.949 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -75.76 -26.11 57.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 63.51 110.868 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.611 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -63.55 167.32 5.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 52.3 111.084 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.92 112.83 30.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 62.3 111.108 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.525 HD11 HD12 ' A' ' 500' ' ' LEU . 43.6 mt -97.67 129.35 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 73.35 111.106 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -123.01 142.67 50.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 53.1 111.088 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -98.64 129.43 45.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 55.32 110.915 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 84.7 t -122.88 102.69 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.257 -0.429 . . . . 73.54 111.151 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.17 109.13 10.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.45 . . . . 64.41 110.935 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -88.46 160.31 45.25 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.584 0.707 . . . . 74.3 111.081 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.3 Cg_endo -69.76 74.48 1.29 Allowed 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.752 2.301 . . . . 75.13 112.315 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.503 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.6 t -176.54 137.02 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 64.31 111.154 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.68 28.64 2.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.435 . . . . 53.21 111.106 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.22 -34.74 3.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 54.42 111.088 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.503 ' O ' HG23 ' A' ' 519' ' ' THR . 13.8 m-85 -149.18 169.9 19.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 72.55 110.969 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 44.9 mtp180 -143.63 162.3 36.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 63.22 110.853 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -96.1 141.24 29.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 71.53 110.883 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.738 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 89.5 m-85 -128.54 124.31 35.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 71.5 110.878 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 526' ' ' LEU . 0.5 OUTLIER -99.53 110.01 22.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 72.15 110.943 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.536 HG12 HD21 ' A' ' 529' ' ' LEU . 21.5 t -101.71 116.73 45.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.459 . . . . 75.53 111.107 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.544 ' O ' HD23 ' A' ' 529' ' ' LEU . 26.1 tttt -96.5 108.25 20.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 71.02 110.881 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.611 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.5 mt -132.7 154.45 81.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.611 0.72 . . . . 75.53 110.903 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 162.09 43.43 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.726 2.284 . . . . 74.3 112.327 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 112.93 3.21 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.697 2.264 . . . . 63.44 112.302 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.5 mt -114.89 -172.68 2.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 62.32 110.921 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 31.6 m -64.32 149.34 48.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 62.11 110.88 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.94 -50.83 60.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.144 -0.48 . . . . 72.33 110.871 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -62.54 -37.19 85.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 74.23 110.853 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -64.49 -53.88 41.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 71.44 110.865 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -57.9 -51.11 70.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 74.52 110.82 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.7 -41.07 94.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.224 -0.444 . . . . 71.23 110.943 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -61.91 -47.36 85.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 64.35 110.884 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.793 HD22 ' CD2' ' A' ' 505' ' ' PHE . 29.6 tp -61.24 -51.1 70.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.188 -0.46 . . . . 71.23 110.961 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -55.52 -45.26 77.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 74.23 110.912 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 11.8 mtp85 -68.15 -38.68 82.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 71.51 110.902 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 543' ' ' LEU . . . . . 0.533 ' O ' HD23 ' A' ' 543' ' ' LEU . 4.9 tt -60.52 -41.94 95.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 44.32 110.93 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 544' ' ' PHE . . . . . 0.504 ' CE2' HD11 ' A' ' 540' ' ' LEU . 9.8 m-85 -72.16 -50.64 26.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 71.21 110.832 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 545' ' ' ALA . . . . . 0.471 ' HA ' ' HB3' ' A' ' 550' ' ' ALA . . . -61.47 -26.36 67.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 60.51 111.142 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 67.5 p -80.72 -62.67 1.6 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 71.34 110.908 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -65.98 -58.95 4.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.113 -0.494 . . . . 74.21 110.891 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.508 HD21 HG11 ' A' ' 491' ' ' VAL . 1.8 tp -68.92 -8.53 45.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.158 -0.473 . . . . 65.32 110.93 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt 64.61 22.84 12.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 62.43 110.883 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 550' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' A' ' 545' ' ' ALA . . . -72.32 178.46 3.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 65.1 111.077 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 63.3 m -145.03 110.91 5.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 72.21 111.111 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.2 t -52.15 123.63 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 74.15 111.156 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 553' ' ' LEU . . . . . 0.603 HD21 ' HB2' ' A' ' 486' ' ' ARG . 18.4 mt -103.78 -49.64 3.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 73.3 110.942 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -151.26 172.67 15.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 63.44 111.082 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 89.3 p -163.35 155.23 17.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 61.41 110.886 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -141.13 140.78 34.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 71.44 110.913 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 14.0 m -143.05 145.74 33.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 74.21 111.092 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 42.4 t -109.79 114.05 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 65.31 111.114 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 C-N-CA 120.723 -0.751 . . . . 73.24 112.437 -180.0 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 16.1 mtm . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.828 0.347 . . . . 72.13 110.883 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 33.2 m -143.2 155.03 16.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.264 -0.425 . . . . 75.03 111.089 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 148.89 -127.57 2.55 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.727 -0.749 . . . . 73.14 112.498 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -168.76 167.16 11.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.85 0.357 . . . . 52.11 110.871 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -120.56 82.15 1.87 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 63.14 110.908 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -116.46 125.4 51.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 63.12 110.908 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 4.5 m 55.9 37.22 28.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 72.22 110.809 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 33.6 pt -60.5 -178.2 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 72.04 111.174 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -105.73 -21.43 13.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.244 -0.434 . . . . 73.41 110.884 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -105.53 78.67 1.38 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 72.13 110.95 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 2.8 m -103.0 157.0 17.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 74.44 111.123 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -142.64 -113.42 0.95 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.699 -0.762 . . . . 64.24 112.481 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -178.19 157.68 21.91 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.758 -0.734 . . . . 63.11 112.518 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' THR . . . . . 0.626 ' OG1' HG23 ' A' ' 557' ' ' THR . 34.0 m -131.5 110.71 11.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.76 0.314 . . . . 75.02 111.117 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.48 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -96.59 119.73 35.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 60.14 111.147 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -110.43 113.77 26.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.995 0.426 . . . . 65.15 110.916 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.495 HG23 HD22 ' A' ' 526' ' ' LEU . 1.3 m -97.89 112.31 24.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.099 -0.501 . . . . 74.24 111.098 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.453 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.7 pt? -134.19 142.39 47.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 73.24 110.917 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -88.85 141.5 28.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 72.13 110.892 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 487' ' ' ALA . . . . . 0.697 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -140.4 160.95 38.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 72.33 111.102 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 488' ' ' GLU . . . . . 0.63 ' HG3' HG23 ' A' ' 491' ' ' VAL . 7.0 pt-20 -51.76 156.9 2.16 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.613 0.721 . . . . 74.11 110.89 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -9.14 25.37 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.686 2.257 . . . . 64.21 112.326 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -80.7 -43.08 20.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 73.22 110.82 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.63 HG23 ' HG3' ' A' ' 488' ' ' GLU . 72.1 t -65.69 134.19 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 75.01 111.116 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -125.81 175.88 7.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 61.11 110.903 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 60.6 t -51.65 -49.91 32.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 74.22 111.113 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -51.93 -41.46 62.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 63.21 110.899 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 88.4 m -67.91 -37.96 82.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.113 -0.494 . . . . 74.14 111.147 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.624 ' HB3' HD13 ' A' ' 512' ' ' ILE . 3.9 mt -64.94 -50.95 64.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 63.12 110.942 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 17.9 ptt85 -63.86 -42.94 97.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 62.31 110.855 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -61.66 -41.73 97.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.447 . . . . 73.42 110.862 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -69.46 -40.39 77.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 53.02 110.906 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.92 -51.77 67.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 72.54 110.936 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.87 -38.34 82.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 73.42 110.895 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -57.92 -48.84 78.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 61.21 110.901 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -67.67 -24.9 65.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 74.32 110.866 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -18.46 18.92 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.704 -0.76 . . . . 71.21 112.48 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.427 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.5 m-85 -65.35 160.27 59.96 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.705 0.765 . . . . 75.41 110.838 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 95.6 0.56 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.682 2.255 . . . . 64.25 112.334 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -112.3 -51.97 0.53 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.717 -0.754 . . . . 63.54 112.454 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -52.04 -51.56 56.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.713 0.292 . . . . 72.43 110.86 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -27.39 65.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 74.12 110.846 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.599 ' HB1' ' O ' ' A' ' 528' ' ' LYS . . . -68.61 175.26 3.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 74.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.02 111.11 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.466 . . . . 71.32 111.151 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.624 HD13 ' HB3' ' A' ' 496' ' ' LEU . 69.5 mt -97.45 140.92 16.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 75.41 111.119 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.5 m -136.16 147.46 47.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 62.33 111.175 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -98.72 143.62 28.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.221 -0.445 . . . . 74.13 110.933 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 60.0 t -139.0 111.01 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.182 -0.463 . . . . 72.53 111.122 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.66 113.42 15.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 75.3 110.897 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.589 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -95.06 160.27 31.25 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.571 0.7 . . . . 73.54 111.099 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.589 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.4 Cg_endo -69.74 74.56 1.27 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.707 2.271 . . . . 63.34 112.316 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.583 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.9 t -176.59 139.24 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 62.44 111.093 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.5 27.27 4.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 72.21 111.098 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.5 -34.94 3.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 53.32 111.12 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.583 ' O ' HG23 ' A' ' 519' ' ' THR . 12.5 m-85 -146.03 162.63 37.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.241 -0.436 . . . . 74.14 110.945 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 71.3 mtt-85 -130.37 160.93 32.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.095 -0.502 . . . . 72.02 110.904 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 63.7 tt0 -94.23 139.76 30.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 63.12 110.905 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.697 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 89.6 m-85 -127.85 124.64 38.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 74.52 110.905 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.495 HD22 HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -101.09 103.58 14.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.164 -0.471 . . . . 64.31 110.966 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.548 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.5 t -96.82 127.94 48.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 73.23 111.142 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.599 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 41.6 tttt -106.91 109.0 20.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 75.55 110.871 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.594 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.5 mt -130.6 154.39 81.7 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.587 0.708 . . . . 74.55 110.921 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 162.14 43.2 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.654 2.236 . . . . 72.24 112.31 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 109.63 2.37 Favored 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.697 2.264 . . . . 74.52 112.31 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.7 mt -111.54 -172.35 2.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 75.5 110.943 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.66 153.67 42.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 63.3 110.827 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -52.1 -46.35 65.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 74.25 110.826 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -60.34 -36.0 76.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 74.22 110.877 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -66.36 -56.62 10.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 74.11 110.861 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 -54.93 -44.84 74.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.461 . . . . 74.14 110.878 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.51 HD22 ' NE ' ' A' ' 542' ' ' ARG . 2.3 mt -67.9 -41.04 83.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 74.05 110.92 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.17 -46.83 85.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.21 -0.45 . . . . 75.53 110.919 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.427 HD22 ' CD2' ' A' ' 505' ' ' PHE . 23.9 tp -64.95 -51.15 63.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 71.42 110.931 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -58.47 -50.25 74.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 75.22 110.902 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 542' ' ' ARG . . . . . 0.51 ' NE ' HD22 ' A' ' 538' ' ' LEU . 96.8 mtt180 -58.45 -53.25 60.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 62.42 110.878 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 543' ' ' LEU . . . . . 0.48 ' O ' HD23 ' A' ' 543' ' ' LEU . 5.7 tt -52.76 -43.48 65.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 74.11 110.897 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -60.68 -56.47 20.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.456 . . . . 74.15 110.915 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.32 -13.34 60.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 75.3 111.121 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.65 -57.27 3.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 63.31 110.85 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -88.36 -52.29 5.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 70.34 110.831 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.77 -12.37 60.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 72.21 110.916 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp 57.25 23.53 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 74.45 110.924 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.36 174.21 2.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 54.34 111.079 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 92.4 m -135.49 110.96 9.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.215 -0.448 . . . . 61.5 111.114 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.7 t -58.22 108.34 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 44.13 111.133 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 10.3 mt -84.49 -49.2 8.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 74.54 110.963 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -159.03 173.8 15.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.468 . . . . 73.23 111.144 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 93.8 p -165.57 139.32 4.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 62.42 110.848 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.48 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 1.2 pm0 -134.73 145.49 48.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 72.2 110.877 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 557' ' ' THR . . . . . 0.626 HG23 ' OG1' ' A' ' 481' ' ' THR . 6.1 m -139.1 138.73 37.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.17 -0.468 . . . . 65.31 111.143 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 41.7 t -86.13 106.04 15.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.179 -0.464 . . . . 54.14 111.132 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.3 0 C-N-CA 120.723 -0.751 . . . . 45.04 112.491 179.982 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.8 0.333 . . . . 74.3 110.899 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 14.4 p -166.01 149.54 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.255 -0.429 . . . . 45.01 111.095 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -91.26 -104.77 1.36 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.745 -0.741 . . . . 73.13 112.504 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -144.7 116.12 8.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.869 0.366 . . . . 73.31 110.878 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -153.31 133.49 13.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 70.25 110.89 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 24.5 p90 -116.27 126.62 53.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 63.34 110.916 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 14.4 m -151.2 122.74 7.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 62.05 110.83 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 34.9 pt -113.14 148.2 16.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 74.33 111.134 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -159.95 113.19 2.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 75.12 110.894 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -108.94 -71.61 0.76 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 73.33 110.866 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 95.2 m -154.47 126.05 7.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 74.33 111.133 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 178.18 -94.18 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.772 -0.728 . . . . 61.45 112.465 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 106.63 150.35 17.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.72 -0.752 . . . . 71.25 112.487 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 2.7 m -125.29 107.51 10.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.743 0.306 . . . . 51.53 111.128 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.0 116.58 28.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 52.41 111.107 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -105.95 114.21 28.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 74.21 110.909 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.493 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.9 OUTLIER -98.54 113.89 26.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 74.22 111.108 -179.976 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.492 ' H ' HD23 ' A' ' 485' ' ' LEU . 2.0 pt? -133.15 147.02 52.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 72.4 110.943 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.92 147.12 23.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 74.31 110.855 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 487' ' ' ALA . . . . . 0.679 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -156.73 165.81 35.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 75.54 111.069 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -53.64 153.52 7.83 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.65 0.738 . . . . 61.13 110.9 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.7 -12.32 32.77 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.692 2.261 . . . . 74.43 112.326 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -74.24 -38.34 63.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 71.22 110.886 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 93.6 t -65.85 124.47 20.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 71.43 111.114 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -114.97 174.65 5.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 73.22 110.894 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.447 HG13 ' HB ' ' A' ' 512' ' ' ILE . 96.2 t -52.05 -45.77 41.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.173 -0.467 . . . . 65.33 111.151 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -54.42 -40.22 68.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 61.44 110.909 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 85.5 m -67.04 -44.17 80.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 73.12 111.179 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.547 ' CB ' HD13 ' A' ' 512' ' ' ILE . 5.1 mt -62.22 -51.04 69.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.435 . . . . 74.53 110.911 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 497' ' ' ARG . . . . . 0.447 ' HB3' HD12 ' A' ' 512' ' ' ILE . 26.5 ptt180 -64.35 -35.95 82.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 75.34 110.869 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -63.92 -46.05 86.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 74.23 110.894 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -69.99 -36.11 74.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 75.22 110.925 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.603 HD12 HD11 ' A' ' 512' ' ' ILE . 35.7 mt -62.66 -52.78 61.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 72.04 110.912 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -68.62 -38.04 80.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 75.33 110.925 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -58.7 -48.02 82.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 72.15 110.878 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -67.38 -24.33 65.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 75.13 110.908 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.01 -18.86 18.6 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.738 -0.744 . . . . 70.15 112.513 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.671 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.1 m-85 -62.57 160.3 35.77 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.673 0.749 . . . . 71.43 110.896 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 93.18 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.747 2.298 . . . . 72.24 112.348 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -106.96 -41.03 1.74 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.733 -0.746 . . . . 73.52 112.513 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -58.75 -51.67 68.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.755 0.312 . . . . 75.54 110.94 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -31.19 67.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.439 . . . . 70.43 110.932 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.635 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -63.64 169.91 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 54.14 111.065 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.96 111.27 25.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 72.24 111.151 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.603 HD11 HD12 ' A' ' 500' ' ' LEU . 73.4 mt -96.87 136.35 27.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.2 -0.455 . . . . 72.02 111.131 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.6 m -137.44 140.58 41.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 73.34 111.109 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -91.98 143.0 26.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.443 . . . . 72.43 110.885 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 99.0 t -133.74 125.65 49.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 64.42 111.143 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -79.97 126.29 30.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 54.24 110.951 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.586 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -109.53 160.2 28.69 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.564 0.697 . . . . 71.31 111.112 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.586 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.6 Cg_endo -69.81 74.6 1.3 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.637 2.224 . . . . 72.45 112.35 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.504 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.9 t -179.91 137.11 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 54.11 111.123 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.6 24.49 5.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 74.4 111.114 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.03 -35.31 3.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 44.31 111.106 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.504 ' O ' HG23 ' A' ' 519' ' ' THR . 7.7 m-85 -135.38 167.22 21.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 63.25 110.914 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 7.8 mmm-85 -137.26 162.2 34.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 71.41 110.886 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -95.47 144.84 25.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 74.02 110.909 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.679 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 92.6 m-85 -131.52 122.29 25.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.45 110.898 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.493 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.4 OUTLIER -103.11 103.57 13.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 73.03 110.899 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.533 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.5 t -96.59 128.36 47.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 74.51 111.142 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.538 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 38.4 tttm -104.65 108.55 20.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 64.44 110.873 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.635 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.9 mt -130.92 154.36 81.95 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.624 0.726 . . . . 61.54 110.924 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 162.09 43.41 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.697 2.265 . . . . 73.33 112.338 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.73 105.21 1.44 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.67 2.247 . . . . 75.52 112.321 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -105.04 -171.1 1.86 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 63.05 110.943 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 43.2 t -73.53 151.04 41.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 73.24 110.847 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -52.0 -50.02 62.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 64.34 110.912 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.3 -49.26 77.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.166 -0.47 . . . . 70.0 110.893 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 14.9 mmp_? -56.45 -56.78 16.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.162 -0.472 . . . . 61.53 110.902 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 26.1 mtp180 -53.35 -46.51 69.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 72.33 110.863 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.1 mt -61.44 -37.67 84.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.446 . . . . 72.43 110.945 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -66.3 -44.28 83.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.172 -0.467 . . . . 74.21 110.897 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.671 HD22 ' CD2' ' A' ' 505' ' ' PHE . 21.5 tp -63.04 -51.16 67.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 75.34 110.96 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -58.47 -49.55 76.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.457 . . . . 70.13 110.873 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 60.8 mtt-85 -58.48 -53.03 62.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 73.33 110.876 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 543' ' ' LEU . . . . . 0.462 ' O ' HD23 ' A' ' 543' ' ' LEU . 5.0 tt -52.71 -44.8 66.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 74.33 110.917 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -59.67 -56.39 22.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 63.15 110.871 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.3 -13.29 60.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 31.12 111.092 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 16.8 t -79.51 -57.26 3.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 74.42 110.849 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -88.37 -52.16 5.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 73.44 110.89 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.447 HD23 ' HB2' ' A' ' 550' ' ' ALA . 1.3 tp -67.83 -12.47 60.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 75.42 110.927 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 32.9 mmtm 57.62 23.11 8.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 75.54 110.87 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 550' ' ' ALA . . . . . 0.447 ' HB2' HD23 ' A' ' 548' ' ' LEU . . . -66.18 -179.66 0.8 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 34.54 111.09 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 27.8 m -141.71 110.94 6.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 72.12 111.191 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.12 107.61 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 74.35 111.137 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 11.7 mt -83.28 -49.92 8.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 75.32 110.942 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.46 174.92 11.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 72.34 111.057 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 82.7 p -156.98 154.91 30.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 74.54 110.848 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -128.77 143.14 50.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.11 -0.496 . . . . 55.41 110.895 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 7.3 m -141.1 144.49 34.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 64.22 111.132 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 22.7 t -112.29 112.57 41.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 65.45 111.108 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 C-N-CA 120.768 -0.73 . . . . 73.44 112.494 179.953 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 57.1 mmm . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.827 0.346 . . . . 73.24 110.914 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 22.5 m -147.08 130.38 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 71.31 111.152 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -154.24 105.48 0.27 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.767 -0.73 . . . . 51.02 112.51 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -90.47 61.84 5.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.912 0.387 . . . . 71.12 110.891 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -170.09 134.99 1.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 64.25 110.906 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -141.89 120.21 12.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.176 -0.465 . . . . 72.04 110.941 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 25.6 p -130.31 169.12 15.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 74.44 110.888 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 66.7 mt -123.69 140.27 47.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 74.35 111.123 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -160.55 114.33 2.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 75.44 110.871 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -123.52 -55.37 1.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 74.24 110.846 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 14.8 t -128.37 171.91 11.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 74.52 111.184 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 109.46 117.36 3.95 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.731 -0.747 . . . . 72.53 112.532 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -129.92 149.15 18.73 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.739 -0.743 . . . . 73.23 112.455 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' THR . . . . . 0.45 HG23 ' OG1' ' A' ' 557' ' ' THR . 16.0 m -126.77 109.01 11.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.811 0.339 . . . . 75.42 111.153 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.688 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -95.53 130.14 42.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 72.33 111.08 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -119.34 113.6 21.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.203 -0.453 . . . . 65.44 110.953 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.464 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.9 OUTLIER -96.78 110.98 23.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 64.3 111.126 -179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.489 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -132.51 143.51 49.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 72.11 110.957 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -91.05 142.82 27.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 73.42 110.878 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 487' ' ' ALA . . . . . 0.519 ' HB3' ' CE1' ' A' ' 525' ' ' PHE . . . -144.58 170.9 15.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 71.24 111.103 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.28 160.54 40.06 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.607 0.718 . . . . 73.14 110.908 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 -14.53 36.25 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.683 2.255 . . . . 72.32 112.334 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -73.22 -44.99 58.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 61.31 110.849 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.541 HG11 HD21 ' A' ' 548' ' ' LEU . 98.5 t -64.06 138.45 23.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 71.51 111.13 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -136.27 178.98 6.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 71.43 110.882 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.463 HG13 ' HB ' ' A' ' 512' ' ' ILE . 48.5 t -51.74 -48.63 37.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 60.54 111.121 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 60.7 tt0 -51.7 -39.91 59.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 65.12 110.852 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.0 m -71.55 -35.42 70.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 72.51 111.195 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.598 ' CB ' HD13 ' A' ' 512' ' ' ILE . 4.9 mt -67.38 -44.71 78.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 73.25 110.888 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -69.97 -46.03 66.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 71.31 110.876 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.8 ptm180 -64.61 -32.7 74.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 53.33 110.895 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -73.8 -45.11 53.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 71.1 110.867 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.412 HD23 HD11 ' A' ' 540' ' ' LEU . 50.3 mt -62.58 -42.45 99.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 74.23 110.92 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.17 -37.79 66.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 73.35 110.896 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -61.45 -47.47 85.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 73.5 110.882 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -69.14 -24.29 64.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.164 -0.471 . . . . 73.11 110.913 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.05 -16.75 20.24 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.77 -0.729 . . . . 54.43 112.453 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.411 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.6 m-85 -68.07 160.25 75.58 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.646 0.736 . . . . 72.23 110.834 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 97.25 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.649 2.233 . . . . 61.44 112.363 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -109.83 -44.9 1.0 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.734 -0.746 . . . . 74.43 112.513 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -60.2 -52.0 67.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.757 0.313 . . . . 74.15 110.946 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -66.71 -33.4 75.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 74.55 110.907 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.622 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -63.78 175.4 1.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 71.01 111.096 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -127.04 116.35 44.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 74.21 111.137 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.598 HD13 ' CB ' ' A' ' 496' ' ' LEU . 64.1 mt -96.2 143.0 12.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 73.34 111.114 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.94 135.55 32.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.472 . . . . 73.34 111.167 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -94.89 143.98 26.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 72.31 110.888 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 82.7 t -138.62 106.16 3.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 61.53 111.17 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -72.79 101.38 3.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 65.12 110.907 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.564 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -79.96 160.23 69.22 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.589 0.709 . . . . 33.32 111.105 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.564 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.3 Cg_endo -69.71 74.54 1.26 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.703 2.269 . . . . 74.23 112.377 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.602 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.9 t -176.38 139.56 0.35 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 71.22 111.162 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -97.35 26.01 5.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 72.31 111.144 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.63 -35.06 3.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 74.42 111.143 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.602 ' O ' HG23 ' A' ' 519' ' ' THR . 16.6 m-85 -144.12 165.22 28.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.474 . . . . 74.03 110.915 -179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 26.7 mtt-85 -134.57 156.98 47.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.085 -0.507 . . . . 73.41 110.844 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -89.47 135.54 33.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.885 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.519 ' CE1' ' HB3' ' A' ' 487' ' ' ALA . 85.2 m-85 -123.62 123.54 40.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 62.22 110.892 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.464 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -103.61 107.95 19.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.171 -0.468 . . . . 65.12 110.928 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.554 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.4 t -100.57 121.59 51.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.449 . . . . 52.04 111.098 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.607 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 12.8 tttm -99.86 109.27 21.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 64.54 110.933 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.622 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.9 mt -131.24 154.26 81.91 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.596 0.712 . . . . 75.53 110.95 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 162.14 43.22 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.731 2.287 . . . . 72.31 112.329 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.86 109.62 2.38 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.622 2.215 . . . . 64.42 112.32 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.5 mt -111.32 -171.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 71.01 110.941 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 7.3 t -71.02 171.09 11.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 54.02 110.86 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -66.91 -48.18 69.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 74.03 110.873 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -59.07 -34.65 72.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 72.55 110.879 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 23.7 mmt180 -66.32 -55.76 14.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.455 . . . . 75.21 110.889 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -56.32 -43.27 78.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 75.14 110.868 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.3 mt -67.66 -39.35 84.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 75.52 110.938 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -66.31 -48.29 70.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 72.53 110.878 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.412 HD11 HD23 ' A' ' 500' ' ' LEU . 21.4 tp -62.02 -51.11 69.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 65.41 110.943 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -58.37 -51.22 70.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 72.2 110.883 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -57.96 -52.64 64.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 74.12 110.874 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 11.0 mt -52.85 -43.64 66.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 75.41 110.87 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -60.63 -56.52 20.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.438 . . . . 74.51 110.89 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.32 -13.29 60.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 70.32 111.09 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.61 -57.51 3.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.436 . . . . 74.34 110.812 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -88.38 -52.22 5.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 74.02 110.883 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.541 HD21 HG11 ' A' ' 491' ' ' VAL . 2.0 tp -67.84 -12.42 60.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 64.1 110.883 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.13 23.47 8.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 72.14 110.919 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.51 178.5 1.59 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 64.51 111.07 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 24.4 m -145.08 110.99 5.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 73.04 111.124 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 61.0 t -54.22 124.8 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 54.32 111.113 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 41.2 mt -108.2 -47.32 3.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 73.41 110.921 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -151.94 174.06 14.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 51.33 111.105 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 91.2 p -172.23 148.75 2.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.259 -0.428 . . . . 44.31 110.852 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.688 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 22.1 pt-20 -140.49 140.68 35.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.485 . . . . 74.14 110.855 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 557' ' ' THR . . . . . 0.45 ' OG1' HG23 ' A' ' 481' ' ' THR . 8.0 m -137.49 143.91 41.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 73.52 111.115 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 80.5 t -91.61 110.79 23.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.176 -0.466 . . . . 64.43 111.123 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 C-N-CA 120.709 -0.757 . . . . 65.44 112.482 179.954 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 53.5 mtp . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.805 0.336 . . . . 73.25 110.827 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 34.7 m -127.77 173.52 12.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 73.31 111.118 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 174.95 110.23 0.25 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.727 -0.749 . . . . 50.12 112.471 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -157.85 141.55 15.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 75.31 110.895 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -161.41 142.7 11.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 73.24 110.848 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -116.8 133.96 55.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 61.12 110.891 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 2.9 m -119.48 127.53 53.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.086 -0.506 . . . . 65.12 110.862 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 19.9 pt -116.71 160.64 16.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.105 -0.498 . . . . 73.41 111.146 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -91.19 -21.5 21.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.451 . . . . 71.12 110.878 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -51.94 -35.61 46.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.11 110.868 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 478' ' ' THR . . . . . 0.483 HG21 ' HB3' ' A' ' 531' ' ' PRO . 1.5 m -69.07 146.32 52.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 74.14 111.1 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -103.61 -89.7 2.12 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.729 -0.748 . . . . 73.1 112.5 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -126.98 164.17 20.64 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.752 -0.737 . . . . 74.24 112.493 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 29.8 m -131.36 112.95 13.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.351 . . . . 73.21 111.135 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.775 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -95.02 127.68 41.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 52.04 111.121 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -116.4 109.84 17.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.451 . . . . 72.34 110.907 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.585 HG23 HD23 ' A' ' 526' ' ' LEU . 0.5 OUTLIER -94.05 114.63 26.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 65.11 111.119 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.454 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -137.33 143.56 42.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 61.22 110.927 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.753 ' HB2' HD11 ' A' ' 553' ' ' LEU . 19.6 ttm180 -95.86 143.15 27.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 72.22 110.865 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -145.77 171.03 15.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 74.42 111.1 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -61.28 160.66 21.95 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.673 0.749 . . . . 74.53 110.87 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -15.36 37.0 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.66 2.24 . . . . 71.11 112.357 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -69.73 -46.72 65.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 71.31 110.881 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 41.0 t -68.81 127.79 31.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 72.45 111.177 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -123.05 178.77 4.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.449 . . . . 74.15 110.931 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 59.1 t -51.65 -47.77 37.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 74.0 111.133 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -51.77 -40.18 59.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 54.21 110.923 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.1 m -71.12 -35.36 71.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 74.34 111.14 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.579 ' CB ' HD13 ' A' ' 512' ' ' ILE . 3.6 mt -67.3 -45.65 75.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 75.41 110.924 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -68.87 -46.13 69.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 74.43 110.865 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -64.86 -32.28 73.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 72.04 110.822 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -73.42 -44.6 57.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 73.24 110.92 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.74 -41.99 97.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.137 -0.483 . . . . 75.24 110.96 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -73.09 -37.71 66.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 73.13 110.949 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.32 -48.2 80.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.104 -0.498 . . . . 74.22 110.842 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -67.78 -24.44 65.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 73.01 110.858 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -15.93 20.75 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.756 -0.735 . . . . 64.54 112.505 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.505 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.6 m-85 -64.7 160.27 54.88 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.681 0.753 . . . . 72.02 110.853 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 91.09 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.698 2.266 . . . . 72.34 112.359 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -106.93 -28.16 5.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.717 -0.754 . . . . 61.04 112.518 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -64.38 -51.85 61.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.778 0.323 . . . . 73.54 110.92 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -75.66 -34.38 60.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 70.31 110.883 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.559 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -52.85 165.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 61.23 111.1 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.04 110.95 24.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 72.14 111.112 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.579 HD13 ' CB ' ' A' ' 496' ' ' LEU . 61.1 mt -90.66 142.99 12.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 72.32 111.158 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.59 133.26 47.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 63.23 111.147 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 514' ' ' GLN . . . . . 0.409 HE21 ' N ' ' A' ' 515' ' ' VAL . 26.6 tp60 -97.35 118.54 34.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.14 110.936 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 515' ' ' VAL . . . . . 0.409 ' N ' HE21 ' A' ' 514' ' ' GLN . 98.1 t -123.32 97.69 4.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.251 -0.431 . . . . 43.31 111.184 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -74.87 99.06 3.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.43 110.908 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.592 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -66.98 160.32 70.83 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.567 0.699 . . . . 65.33 111.133 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.592 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.78 74.41 1.3 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.707 2.271 . . . . 62.34 112.354 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.9 t 179.1 140.21 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.231 -0.44 . . . . 74.24 111.097 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.41 33.24 1.62 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 71.11 111.111 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.63 -33.94 3.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 72.15 111.122 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -147.74 176.97 9.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 65.33 110.918 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -148.06 149.12 31.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 63.04 110.891 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -91.9 138.84 31.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 72.54 110.938 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -130.64 133.77 46.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 72.44 110.936 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.585 HD23 HG23 ' A' ' 484' ' ' THR . 0.6 OUTLIER -109.44 106.08 15.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 73.23 110.889 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.652 HG12 HD21 ' A' ' 529' ' ' LEU . 21.2 t -96.02 112.27 27.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 60.5 111.139 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.502 ' O ' HD23 ' A' ' 529' ' ' LEU . 35.3 tttp -90.47 112.11 23.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 73.31 110.913 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.652 HD21 HG12 ' A' ' 527' ' ' VAL . 6.5 mt -132.67 154.28 81.42 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.592 0.711 . . . . 72.11 110.895 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 162.2 42.99 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.67 2.247 . . . . 71.12 112.342 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 531' ' ' PRO . . . . . 0.483 ' HB3' HG21 ' A' ' 478' ' ' THR . 53.9 Cg_endo -69.75 107.46 1.86 Allowed 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.665 2.244 . . . . 73.41 112.361 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -109.12 -170.99 1.76 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.195 -0.457 . . . . 71.35 110.958 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 7.8 p -72.74 152.05 41.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 74.52 110.89 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -51.94 -41.18 61.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.154 -0.475 . . . . 70.13 110.864 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -62.09 -43.93 97.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 62.15 110.858 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? -64.64 -48.48 74.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 74.32 110.903 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -56.41 -52.98 62.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 73.23 110.858 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -64.34 -40.51 96.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 74.34 110.925 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.46 -46.17 91.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 55.15 110.848 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.505 HD22 ' CD2' ' A' ' 505' ' ' PHE . 24.0 tp -64.01 -51.06 65.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 44.12 110.863 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -57.78 -50.12 74.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 72.54 110.871 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -57.94 -53.44 58.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 63.35 110.899 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 543' ' ' LEU . . . . . 0.447 ' O ' HD23 ' A' ' 543' ' ' LEU . 3.0 tt -52.63 -43.37 65.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 64.45 110.922 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -60.63 -56.53 20.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.21 110.894 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.43 -13.3 60.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 52.11 111.063 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.59 -57.3 3.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 73.03 110.882 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -88.36 -52.24 5.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.14 -0.482 . . . . 73.41 110.914 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.86 -12.42 60.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.54 110.933 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt 57.45 23.27 8.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.168 -0.469 . . . . 74.34 110.901 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.26 -179.05 0.92 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 73.43 111.075 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 89.8 m -145.01 110.95 5.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 70.13 111.171 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 31.7 t -55.62 108.53 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 72.3 111.149 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 553' ' ' LEU . . . . . 0.753 HD11 ' HB2' ' A' ' 486' ' ' ARG . 27.2 mt -85.43 -43.19 13.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 73.52 110.925 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -166.54 174.54 8.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 64.31 111.059 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 75.7 m -161.38 148.93 15.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.454 . . . . 73.23 110.845 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.775 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 24.9 pt-20 -143.88 154.7 43.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 71.4 110.874 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 10.4 m -144.21 129.71 19.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 61.42 111.16 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 21.8 t -79.87 103.27 6.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.217 -0.447 . . . . 73.34 111.135 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.711 -0.757 . . . . 51.41 112.418 -179.975 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 17.9 ptp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.798 0.332 . . . . 64.21 110.91 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 27.8 m -110.77 138.26 39.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.255 -0.43 . . . . 74.43 111.135 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -68.03 -140.8 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.764 -0.732 . . . . 63.22 112.515 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -119.7 -56.98 2.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.879 0.371 . . . . 75.1 110.915 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -141.0 149.24 41.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 74.04 110.867 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -148.4 128.54 13.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 73.52 110.926 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 17.6 m -146.44 161.29 40.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 74.45 110.901 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 32.5 mm -104.38 136.67 36.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 72.04 111.119 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -113.14 -21.51 10.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 73.54 110.897 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 10.4 t80 62.95 35.95 12.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 72.51 110.868 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 478' ' ' THR . . . . . 0.445 HG23 ' O ' ' A' ' 558' ' ' VAL . 34.4 m -72.3 137.41 46.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 75.31 111.117 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -69.33 -110.46 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.735 -0.745 . . . . 60.31 112.473 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -113.61 160.57 13.08 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.747 -0.739 . . . . 73.04 112.507 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 61.3 m -125.13 114.15 18.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 71.41 111.129 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.769 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -98.87 138.71 35.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 71.41 111.085 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -123.89 112.13 16.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 74.43 110.916 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.8 m -93.89 110.14 21.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 73.14 111.112 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.481 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.7 pt? -132.57 145.35 51.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 73.2 110.938 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 23.5 ttp180 -100.0 129.01 46.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 75.42 110.866 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -131.83 170.97 14.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 63.21 111.083 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -58.19 160.26 9.49 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.643 0.735 . . . . 62.33 110.86 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -15.66 37.17 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.724 2.282 . . . . 74.01 112.324 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -71.7 -45.56 61.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 64.1 110.93 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.532 HG11 HD21 ' A' ' 548' ' ' LEU . 99.2 t -61.42 121.11 8.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 63.33 111.123 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -117.07 173.79 6.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 73.32 110.913 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.5 t -51.56 -48.5 35.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 51.44 111.111 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -52.44 -39.81 61.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 52.34 110.896 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.3 m -71.2 -35.58 71.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 65.35 111.151 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.759 ' HB3' HD13 ' A' ' 512' ' ' ILE . 2.8 mt -67.36 -45.58 75.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 74.24 110.908 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.6 ptt85 -69.0 -46.05 69.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 72.34 110.892 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -64.86 -32.12 73.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 74.41 110.82 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -73.36 -45.64 53.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.222 -0.445 . . . . 74.34 110.861 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 49.2 mt -62.86 -42.1 99.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 73.14 110.891 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -73.06 -37.65 66.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.431 . . . . 73.21 110.902 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -61.38 -48.92 79.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 72.45 110.955 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -67.51 -22.78 65.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.491 . . . . 61.05 110.907 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -18.43 18.95 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.739 -0.743 . . . . 74.11 112.474 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.493 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.4 m-85 -66.08 160.3 64.74 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.664 0.745 . . . . 74.12 110.876 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 101.93 0.97 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.71 2.273 . . . . 70.55 112.319 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -120.72 -30.55 1.36 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.731 -0.747 . . . . 75.33 112.472 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.2 -42.28 65.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.707 0.289 . . . . 71.31 110.882 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -80.46 -36.83 32.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 73.41 110.898 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.627 ' HB1' ' O ' ' A' ' 528' ' ' LYS . . . -59.21 177.46 0.17 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.159 -0.473 . . . . 72.24 111.068 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.0 112.52 29.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 73.52 111.123 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.759 HD13 ' HB3' ' A' ' 496' ' ' LEU . 47.3 mt -96.16 128.06 47.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 54.21 111.12 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.98 147.21 46.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 61.45 111.122 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.5 tm0? -103.61 144.02 31.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 74.31 110.927 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 94.5 t -136.57 108.73 7.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 71.32 111.127 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.01 109.72 15.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 74.15 110.951 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.589 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -89.44 160.32 42.39 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.561 0.696 . . . . 71.1 111.139 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.589 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.8 Cg_endo -69.75 74.44 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.696 2.264 . . . . 73.24 112.35 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t 179.27 136.54 0.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 75.2 111.127 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -96.46 32.32 2.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 43.21 111.07 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.97 -34.16 3.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 44.55 111.092 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -150.81 145.67 25.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.208 -0.451 . . . . 74.34 110.944 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -115.98 154.39 29.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.117 -0.492 . . . . 74.43 110.87 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 524' ' ' GLU . . . . . 0.549 ' HG2' HD12 ' A' ' 553' ' ' LEU . 7.2 mt-10 -92.18 149.23 21.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 72.13 110.893 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -138.96 133.51 31.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 73.41 110.907 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.769 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.4 OUTLIER -109.15 106.8 16.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.131 -0.486 . . . . 52.44 110.937 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.596 HG12 HD21 ' A' ' 529' ' ' LEU . 19.9 t -95.97 113.27 29.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 63.25 111.159 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.627 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 2.9 tptm -92.46 108.57 20.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.24 110.901 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.621 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -132.45 154.55 81.6 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.608 0.718 . . . . 73.4 110.907 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 162.29 42.62 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.719 2.28 . . . . 63.52 112.382 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 103.98 1.25 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.7 2.267 . . . . 72.05 112.334 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.4 mt -103.62 -171.05 1.87 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 73.43 110.917 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 28.4 t -70.22 149.06 47.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 62.1 110.815 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -51.71 -48.45 63.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 75.42 110.848 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.1 -44.82 96.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 72.43 110.927 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 21.7 mmt85 -59.07 -55.85 29.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 73.15 110.843 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 67.4 mtp180 -53.83 -53.0 58.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 73.31 110.881 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.1 mt -56.41 -37.01 69.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 75.03 110.903 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.0 -46.0 83.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 73.31 110.864 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.493 HD22 ' CD2' ' A' ' 505' ' ' PHE . 22.1 tp -61.44 -50.86 71.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 61.21 110.906 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -57.3 -50.91 71.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 75.03 110.902 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -58.04 -52.71 64.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.486 . . . . 62.23 110.85 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.4 tt -52.6 -44.19 65.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 61.32 110.913 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -60.43 -56.29 23.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 73.21 110.928 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.01 -13.43 59.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 71.44 111.142 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.9 t -79.66 -57.72 3.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 64.44 110.887 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -88.29 -52.18 5.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.118 -0.492 . . . . 73.3 110.91 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.532 HD21 HG11 ' A' ' 491' ' ' VAL . 0.8 OUTLIER -67.82 -12.43 60.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 74.41 110.944 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 26.8 mmtp 56.74 24.0 8.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 74.41 110.867 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.77 177.72 1.98 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 73.43 111.076 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 40.8 m -140.28 110.87 6.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 71.04 111.136 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.51 102.03 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 64.44 111.137 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 553' ' ' LEU . . . . . 0.549 HD12 ' HG2' ' A' ' 524' ' ' GLU . 28.6 mt -77.85 -43.25 30.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 75.4 110.917 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -168.55 176.44 5.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 53.22 111.109 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 99.2 p -160.18 153.94 22.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 60.11 110.864 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.753 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 8.2 pm0 -142.1 153.39 44.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 74.23 110.895 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 47.3 m -144.29 131.68 20.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.464 . . . . 75.44 111.125 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 558' ' ' VAL . . . . . 0.445 ' O ' HG23 ' A' ' 478' ' ' THR . 43.5 t -76.56 96.89 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 54.21 111.146 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 C-N-CA 120.755 -0.736 . . . . 62.42 112.451 -179.989 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.83 0.348 . . . . 75.21 110.855 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 26.8 m -91.15 141.86 13.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.458 . . . . 44.04 111.137 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 129.34 42.87 0.22 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.747 -0.74 . . . . 52.35 112.504 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -124.08 73.15 1.21 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 63.4 110.858 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -94.43 -28.01 15.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.121 -0.491 . . . . 71.45 110.926 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -72.79 112.79 9.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.486 . . . . 72.35 110.908 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 32.6 p -162.91 126.25 2.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.119 -0.492 . . . . 73.32 110.881 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 47.2 mt -105.88 144.7 14.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 74.41 111.118 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -124.19 68.38 1.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 74.33 110.847 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -142.43 165.17 28.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 72.4 110.826 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 8.9 t -151.01 163.92 37.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 75.22 111.092 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 129.72 -58.42 0.71 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.726 -0.75 . . . . 72.13 112.495 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 111.42 150.27 11.67 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.767 -0.73 . . . . 54.53 112.465 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' THR . . . . . 0.464 HG23 ' O ' ' A' ' 556' ' ' GLU . 25.7 m -128.52 113.4 15.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.825 0.345 . . . . 74.0 111.116 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.795 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -94.91 142.64 27.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 64.31 111.123 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -132.11 110.67 10.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.244 -0.435 . . . . 74.42 110.921 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.638 HG22 ' OE2' ' A' ' 524' ' ' GLU . 0.2 OUTLIER -96.73 114.78 26.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 63.24 111.123 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.442 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.7 pt? -135.76 142.56 44.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 62.34 110.962 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -88.3 146.94 25.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 63.53 110.865 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -152.54 169.73 21.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 44.44 111.131 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -70.49 160.66 80.61 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.669 0.747 . . . . 70.23 110.861 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -10.95 29.76 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.669 2.246 . . . . 74.32 112.301 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -71.29 -31.15 67.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 73.22 110.872 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 23.7 t -86.83 134.77 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.139 -0.482 . . . . 75.31 111.134 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -127.06 177.56 6.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.445 . . . . 74.44 110.9 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 81.8 t -51.96 -50.01 35.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 54.04 111.131 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -53.72 -40.07 65.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 73.55 110.923 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 63.7 m -67.52 -42.8 82.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 72.43 111.162 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.542 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.6 mt -61.21 -51.06 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 63.11 110.933 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 497' ' ' ARG . . . . . 0.401 ' HB3' HD12 ' A' ' 512' ' ' ILE . 9.4 ptm180 -64.1 -40.12 95.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 72.12 110.85 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -60.46 -44.12 96.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 65.44 110.835 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -70.81 -39.55 73.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.441 . . . . 72.31 110.877 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.545 HD12 HD11 ' A' ' 512' ' ' ILE . 36.0 mt -58.87 -49.9 76.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 73.34 110.917 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -72.13 -37.98 69.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 74.31 110.886 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -56.06 -48.75 75.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 61.1 110.914 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.537 ' HE2' HD13 ' A' ' 543' ' ' LEU . 13.7 mmmt -69.71 -23.7 63.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.473 . . . . 73.21 110.948 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.0 -17.68 19.64 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.758 -0.734 . . . . 62.22 112.495 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -63.4 160.26 43.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.628 0.728 . . . . 62.14 110.881 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 93.39 0.52 Allowed 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.673 2.249 . . . . 43.23 112.348 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.16 -28.23 3.41 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.705 -0.76 . . . . 52.31 112.468 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -70.43 -51.74 27.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.718 0.294 . . . . 74.44 110.888 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.38 -34.34 67.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 75.03 110.932 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.652 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -61.46 172.32 1.2 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 62.32 111.107 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.97 116.47 44.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 55.53 111.101 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.545 HD11 HD12 ' A' ' 500' ' ' LEU . 65.5 mt -98.36 123.2 50.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 73.43 111.158 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.7 m -113.91 143.15 45.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 62.03 111.12 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -98.16 128.91 44.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 73.4 110.923 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.72 92.27 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 72.42 111.16 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.7 114.85 5.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 61.44 110.929 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.606 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -88.64 161.17 42.79 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.56 0.695 . . . . 64.13 111.128 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.606 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.76 72.17 1.47 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.762 2.308 . . . . 73.31 112.325 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.4 t 177.23 141.9 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 74.12 111.15 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.87 31.35 2.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 52.32 111.138 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -126.06 -35.67 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 71.13 111.06 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.582 ' O ' HG23 ' A' ' 519' ' ' THR . 18.0 m-85 -150.1 150.55 31.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.226 -0.443 . . . . 63.42 110.898 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.18 161.76 34.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 70.32 110.859 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 524' ' ' GLU . . . . . 0.667 ' OE1' HD12 ' A' ' 553' ' ' LEU . 41.1 tp10 -94.71 152.38 18.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 64.51 110.869 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -136.31 126.94 27.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 72.23 110.868 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.795 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -98.61 107.46 19.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 72.43 110.896 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.554 HG12 HD21 ' A' ' 529' ' ' LEU . 21.4 t -95.88 112.02 27.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 75.41 111.114 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.61 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 0.8 OUTLIER -91.55 108.44 19.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.16 -0.473 . . . . 71.32 110.903 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.652 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.3 mt -131.86 154.47 81.77 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.605 0.717 . . . . 74.23 110.893 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 162.22 42.94 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.675 2.25 . . . . 63.44 112.352 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 106.45 1.67 Allowed 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.733 2.289 . . . . 70.42 112.317 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -108.83 -171.02 1.77 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 74.34 110.941 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 53.7 m -71.79 153.83 41.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 74.55 110.848 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -52.27 -47.44 65.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.128 -0.487 . . . . 60.31 110.844 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -58.95 -37.77 77.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 72.31 110.926 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.4 mmp_? -64.22 -58.04 7.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 71.22 110.839 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -53.1 -47.02 68.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 73.21 110.873 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mt -66.01 -37.04 84.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 63.33 110.882 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -65.97 -46.66 77.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 73.12 110.831 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -63.99 -51.18 65.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 73.23 110.921 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -58.14 -50.45 73.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 71.54 110.854 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -58.05 -53.41 58.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 72.02 110.878 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 543' ' ' LEU . . . . . 0.537 HD13 ' HE2' ' A' ' 503' ' ' LYS . 7.9 mt -52.63 -43.59 65.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 71.32 110.941 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.53 -56.56 19.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 75.41 110.857 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.26 -13.32 60.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 61.31 111.1 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 22.8 t -79.6 -57.39 3.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 75.22 110.845 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -88.4 -52.18 5.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 74.22 110.879 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -12.36 60.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 71.55 110.91 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.5 mmmt 57.11 23.58 8.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 71.24 110.894 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.95 177.86 1.57 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.44 111.077 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 49.1 m -140.39 111.01 6.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 75.13 111.12 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 61.8 t -60.47 119.56 4.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 63.11 111.108 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 553' ' ' LEU . . . . . 0.667 HD12 ' OE1' ' A' ' 524' ' ' GLU . 17.6 mt -103.09 -48.03 4.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 55.12 110.89 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -143.61 170.09 16.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 64.1 111.073 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 54.8 p -175.8 133.99 0.28 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 64.14 110.851 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.464 ' O ' HG23 ' A' ' 481' ' ' THR . 4.3 pt-20 -128.28 140.54 51.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 73.05 110.877 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 557' ' ' THR . . . . . 0.411 HG23 ' OG1' ' A' ' 481' ' ' THR . 3.3 m -133.14 146.54 51.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 75.32 111.168 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 40.0 t -114.73 111.97 38.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 65.41 111.153 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 C-N-CA 120.768 -0.73 . . . . 62.12 112.511 179.991 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 3.6 ptp . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.838 0.351 . . . . 60.31 110.866 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 9.3 p -165.93 141.1 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 72.03 111.168 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -162.87 89.41 0.11 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.792 -0.718 . . . . 65.13 112.474 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -147.26 134.08 20.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.85 0.357 . . . . 74.32 110.864 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -164.72 137.49 4.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 71.24 110.911 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 10.9 p90 -134.48 149.67 50.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 73.01 110.915 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 87.9 p -129.08 179.17 5.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 54.01 110.869 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 2.7 pp -147.28 -177.16 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 70.44 111.119 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -163.93 112.13 1.17 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.191 -0.458 . . . . 75.32 110.893 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -153.88 137.82 16.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.435 . . . . 74.12 110.888 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 11.9 m -125.92 125.67 43.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 63.52 111.123 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' GLY . . . . . 0.449 ' HA3' HG21 ' A' ' 558' ' ' VAL . . . 161.14 -69.01 0.24 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.749 -0.738 . . . . 64.24 112.511 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 133.24 149.52 6.14 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.72 -0.752 . . . . 71.2 112.477 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 97.0 m -129.95 106.89 8.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.783 0.325 . . . . 73.4 111.126 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.708 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -94.97 136.42 35.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 54.52 111.121 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -124.2 111.18 15.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.252 -0.431 . . . . 73.1 110.906 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.504 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.5 OUTLIER -94.92 110.97 22.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 73.2 111.172 -180.0 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.441 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -135.73 146.38 47.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.246 -0.434 . . . . 63.24 110.937 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.59 ' HD3' HD11 ' A' ' 553' ' ' LEU . 26.1 mtp180 -97.4 127.22 43.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.16 -0.473 . . . . 73.53 110.868 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 487' ' ' ALA . . . . . 0.448 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -123.84 171.06 9.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 61.32 111.134 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -66.29 160.63 63.88 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.667 0.746 . . . . 72.25 110.901 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -16.3 37.63 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.692 2.261 . . . . 73.22 112.366 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -72.5 -34.02 67.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 64.44 110.887 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 85.4 t -80.14 124.59 38.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.475 . . . . 71.53 111.132 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -118.61 178.85 4.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 74.54 110.878 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 38.7 t -51.62 -48.73 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 75.24 111.158 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -51.71 -41.12 61.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 65.54 110.882 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.4 m -71.09 -34.55 71.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 54.3 111.14 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.778 ' HB3' HD13 ' A' ' 512' ' ' ILE . 2.3 mt -67.48 -44.54 78.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.451 . . . . 72.15 110.872 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -70.08 -45.55 66.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 65.21 110.849 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -65.05 -32.62 74.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 72.15 110.84 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -73.58 -46.3 48.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 74.02 110.884 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.7 -42.3 98.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 74.45 110.893 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.24 -37.55 66.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 71.35 110.907 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -60.58 -49.31 78.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 75.13 110.897 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -24.02 67.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 72.44 110.918 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.07 -17.73 19.43 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.794 -0.717 . . . . 75.32 112.518 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.464 ' CD2' HD22 ' A' ' 540' ' ' LEU . 15.3 m-85 -68.01 160.3 75.05 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.666 0.746 . . . . 60.44 110.852 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 100.25 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.693 2.262 . . . . 72.21 112.29 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -119.85 -25.19 2.62 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.757 -0.735 . . . . 55.14 112.458 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -72.88 -40.18 65.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.735 0.302 . . . . 71.22 110.914 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -85.23 -34.29 22.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 75.2 110.873 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.633 ' HB1' ' O ' ' A' ' 528' ' ' LYS . . . -61.43 -177.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.445 . . . . 64.33 111.087 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 23.4 t -126.98 143.06 41.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 54.32 111.108 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.778 HD13 ' HB3' ' A' ' 496' ' ' LEU . 30.6 mt -125.61 120.4 57.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.174 -0.466 . . . . 52.54 111.129 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.53 141.6 48.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 74.3 111.163 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -100.37 141.65 32.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 70.53 110.91 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 93.2 t -135.0 108.55 10.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 71.53 111.164 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 12.4 tm0? -71.19 116.74 11.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 74.43 110.947 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.581 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -96.22 160.23 30.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.575 0.702 . . . . 61.14 111.129 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.581 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.8 Cg_endo -69.76 74.6 1.28 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.663 2.242 . . . . 60.54 112.306 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.538 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.3 t 179.99 138.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 73.23 111.1 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.48 27.18 3.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 64.13 111.09 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.53 -34.93 3.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 75.12 111.081 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.538 ' O ' HG23 ' A' ' 519' ' ' THR . 14.1 m-85 -144.98 164.75 30.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 73.42 110.943 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 48.9 mtm180 -137.33 160.61 38.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 63.31 110.898 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -93.98 149.31 21.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 72.02 110.886 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.448 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 83.1 m-85 -142.43 134.57 27.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 72.23 110.848 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.708 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -108.36 107.72 18.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.095 -0.502 . . . . 64.13 110.91 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.575 HG12 HD21 ' A' ' 529' ' ' LEU . 21.3 t -96.2 112.46 28.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 72.45 111.1 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.633 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 34.7 tttt -91.93 108.93 20.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.479 . . . . 73.33 110.901 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.632 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.3 mt -131.89 154.42 81.74 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.631 0.729 . . . . 52.13 110.89 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 162.25 42.79 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.627 2.218 . . . . 71.22 112.341 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 112.42 3.08 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.678 2.252 . . . . 64.11 112.308 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.79 -170.98 1.77 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 63.14 110.91 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 40.9 t -68.88 155.51 40.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 35.02 110.844 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -54.73 -50.31 68.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 54.14 110.905 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -60.06 -37.16 79.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.458 . . . . 64.31 110.881 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -64.19 -55.6 20.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 75.4 110.893 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 53.7 mtm180 -55.81 -53.06 61.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 73.54 110.844 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.0 mt -59.23 -37.77 78.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 71.12 110.897 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.93 -50.07 67.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 65.44 110.877 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.464 HD22 ' CD2' ' A' ' 505' ' ' PHE . 23.0 tp -57.92 -51.08 71.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 60.21 110.922 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 541' ' ' GLU . . . . . 0.402 ' OE1' HG22 ' A' ' 552' ' ' VAL . 17.2 mm-40 -57.26 -50.89 71.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.454 . . . . 74.21 110.869 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -57.88 -51.91 67.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 52.42 110.878 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.8 -44.65 66.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 71.1 110.851 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -60.39 -56.35 22.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 73.43 110.878 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.87 -13.47 59.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 73.34 111.102 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.61 -57.96 3.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 75.21 110.859 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -88.26 -52.2 5.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.489 . . . . 75.35 110.907 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.76 -12.47 60.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 73.54 110.871 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt 56.3 24.37 8.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 75.12 110.905 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.41 174.14 3.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 72.42 111.091 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 93.3 m -133.72 111.69 10.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 73.41 111.13 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 552' ' ' VAL . . . . . 0.402 HG22 ' OE1' ' A' ' 541' ' ' GLU . 42.8 t -59.98 109.04 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 50.41 111.15 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 553' ' ' LEU . . . . . 0.59 HD11 ' HD3' ' A' ' 486' ' ' ARG . 11.7 mt -86.84 -45.38 10.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 75.41 110.922 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.61 172.38 14.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 70.13 111.144 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 20.6 p -158.26 157.37 32.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 73.24 110.877 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -136.45 139.63 42.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 75.43 110.892 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 87.1 m -142.07 144.79 33.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.135 -0.484 . . . . 65.44 111.16 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 558' ' ' VAL . . . . . 0.449 HG21 ' HA3' ' A' ' 479' ' ' GLY . 51.5 t -98.52 111.94 29.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 71.02 111.114 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 C-N-CA 120.759 -0.734 . . . . 55.22 112.517 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.782 0.325 . . . . 75.31 110.893 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 9.9 m -141.35 177.81 3.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.249 -0.432 . . . . 61.02 111.138 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -177.81 -155.72 14.74 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.742 -0.742 . . . . 53.4 112.489 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -102.93 154.92 18.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.903 0.382 . . . . 75.13 110.849 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -61.28 -73.12 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 72.34 110.896 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 43.8 p90 -162.09 -179.17 6.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 75.33 110.947 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 6.7 m -156.73 161.12 39.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 74.42 110.9 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 38.2 pt -100.64 146.97 8.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 64.04 111.141 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -149.29 111.71 4.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 73.12 110.835 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -120.22 40.73 3.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 65.43 110.885 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 478' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 558' ' ' VAL . 0.8 OUTLIER -81.01 158.96 24.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 71.23 111.142 -179.928 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -103.89 -83.44 1.7 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.778 -0.725 . . . . 51.53 112.466 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -129.31 155.45 20.8 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.745 -0.741 . . . . 63.3 112.51 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 25.0 m -127.25 108.65 11.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.835 0.35 . . . . 63.15 111.147 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.622 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -95.41 129.99 42.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 74.45 111.151 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -118.24 113.32 21.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.244 -0.434 . . . . 74.42 110.936 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -94.38 110.33 22.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 71.12 111.115 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.503 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -130.51 143.6 50.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 75.55 110.933 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -94.1 126.77 39.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 73.23 110.894 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -127.02 170.95 11.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 74.42 111.141 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -61.21 160.42 22.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.666 0.746 . . . . 75.14 110.881 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -17.76 37.36 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.698 2.265 . . . . 52.12 112.303 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -73.02 -44.15 61.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 73.0 110.944 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.436 HG21 ' HG ' ' A' ' 548' ' ' LEU . 95.7 t -60.71 125.55 17.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 41.53 111.143 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -123.48 176.68 6.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 71.42 110.862 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 90.3 t -51.63 -49.24 35.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.487 . . . . 73.5 111.096 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -51.17 -40.27 58.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 73.52 110.911 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.3 m -72.96 -35.12 66.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 73.24 111.154 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.587 ' HB3' HD13 ' A' ' 512' ' ' ILE . 4.8 mt -67.46 -44.1 79.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 54.41 110.908 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.05 -46.13 62.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 61.54 110.888 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -63.97 -33.21 75.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 71.42 110.907 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -73.98 -47.44 37.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.465 . . . . 73.42 110.835 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 35.8 mt -59.6 -43.35 93.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 71.04 110.91 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -73.09 -37.76 66.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.169 -0.469 . . . . 71.53 110.92 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.35 -49.04 78.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 65.25 110.871 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.693 ' NZ ' HD13 ' A' ' 543' ' ' LEU . 0.2 OUTLIER -68.2 -24.76 64.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 74.34 110.901 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -17.98 19.34 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.754 -0.736 . . . . 73.04 112.475 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -61.54 160.28 26.81 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.66 0.743 . . . . 71.44 110.846 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 86.87 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.672 2.248 . . . . 72.32 112.32 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -108.89 -22.09 7.12 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.745 -0.74 . . . . 74.23 112.494 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -75.85 -40.79 54.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.727 0.299 . . . . 75.4 110.839 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -85.28 -29.45 24.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.427 . . . . 74.2 110.887 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.632 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -62.77 173.8 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.466 . . . . 64.02 111.078 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.05 117.04 46.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.42 111.152 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.587 HD13 ' HB3' ' A' ' 496' ' ' LEU . 62.1 mt -96.91 137.33 24.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 75.3 111.071 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.13 150.35 52.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 72.41 111.146 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -102.5 144.0 31.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 74.11 110.913 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.5 t -138.62 108.95 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 71.2 111.136 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -77.56 107.42 10.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 65.21 110.929 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.576 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -88.9 160.22 44.13 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.578 0.704 . . . . 72.43 111.103 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.576 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.1 Cg_endo -69.71 74.54 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.68 2.254 . . . . 72.33 112.353 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.1 t -176.03 140.05 0.4 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 75.14 111.136 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -99.95 26.31 6.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 62.45 111.096 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.69 -34.02 3.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 73.22 111.1 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.582 ' O ' HG23 ' A' ' 519' ' ' THR . 12.0 m-85 -145.1 157.28 44.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 74.41 110.925 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.16 157.43 34.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 74.31 110.873 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 524' ' ' GLU . . . . . 0.481 ' CD ' ' HB2' ' A' ' 517' ' ' ALA . 12.4 mt-10 -93.73 141.86 28.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 70.12 110.901 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.448 ' O ' HD23 ' A' ' 485' ' ' LEU . 83.6 m-85 -130.46 128.95 42.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 71.15 110.846 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.622 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.6 OUTLIER -104.15 105.51 15.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 75.25 110.957 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.534 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.2 t -95.98 116.68 38.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 72.15 111.148 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.588 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 5.7 tptm -94.74 107.41 19.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 65.41 110.896 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.632 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.4 mt -130.65 154.29 81.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.56 0.695 . . . . 70.31 110.939 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 162.14 43.25 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.646 2.231 . . . . 61.21 112.341 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 108.83 2.17 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.682 2.254 . . . . 63.42 112.338 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.2 mt -109.41 -171.08 1.77 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 63.51 110.93 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.84 154.88 40.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 54.53 110.82 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -51.98 -46.08 64.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.096 -0.502 . . . . 71.21 110.875 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.85 -36.12 78.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 65.32 110.877 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -65.04 -54.35 31.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 72.24 110.888 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 43.0 mtt180 -57.16 -48.11 79.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 64.34 110.865 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.7 mt -63.8 -43.59 95.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 73.21 110.888 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -62.92 -44.51 95.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 71.51 110.892 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.2 tp -62.35 -51.23 68.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.157 -0.474 . . . . 53.05 110.938 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -56.08 -49.66 73.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 74.31 110.919 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -57.93 -51.91 67.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 72.23 110.857 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 543' ' ' LEU . . . . . 0.693 HD13 ' NZ ' ' A' ' 503' ' ' LYS . 0.5 OUTLIER -52.88 -44.35 66.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 63.12 110.9 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -60.31 -56.74 17.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 72.03 110.84 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.18 -13.11 59.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 70.34 111.122 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.73 -58.31 3.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 60.44 110.816 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -88.56 -52.17 5.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 75.14 110.828 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.436 ' HG ' HG21 ' A' ' 491' ' ' VAL . 1.8 tp -67.76 -12.71 61.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 74.4 110.919 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp 56.65 23.36 7.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.22 110.904 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -71.2 -179.82 2.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 62.42 111.125 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 94.2 m -144.99 111.29 5.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 73.14 111.144 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.4 t -53.23 122.81 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 75.31 111.158 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 553' ' ' LEU . . . . . 0.454 HD12 ' HG2' ' A' ' 524' ' ' GLU . 18.2 mt -101.28 -47.55 4.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 70.12 110.893 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -158.28 175.15 14.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 64.42 111.092 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 88.5 p -161.33 152.71 18.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.443 . . . . 75.24 110.867 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -134.36 149.49 50.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 73.43 110.845 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 51.5 m -144.07 136.1 26.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.121 -0.49 . . . . 45.33 111.089 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 558' ' ' VAL . . . . . 0.469 ' O ' HG22 ' A' ' 478' ' ' THR . 24.2 t -94.14 101.04 12.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 53.13 111.136 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.719 -0.753 . . . . 61.4 112.529 -179.995 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 27.5 mtt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.786 0.327 . . . . 64.03 110.895 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 60.1 t -112.08 118.93 58.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.287 -0.415 . . . . 40.45 111.149 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -144.17 93.33 0.17 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.698 -0.763 . . . . 62.34 112.527 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -109.98 -68.8 0.9 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.824 0.345 . . . . 71.41 110.894 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -111.97 105.35 13.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 64.22 110.868 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -58.24 120.19 8.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 75.12 110.914 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 2.4 m -119.85 153.54 35.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 73.44 110.873 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 475' ' ' ILE . . . . . 0.529 HD12 ' HB2' ' A' ' 477' ' ' PHE . 22.4 pt -108.75 174.53 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 72.25 111.144 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.11 -21.32 39.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 61.22 110.862 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.529 ' HB2' HD12 ' A' ' 475' ' ' ILE . 6.0 m-85 -74.16 99.34 3.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 64.31 110.881 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 9.8 t -141.65 153.28 44.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 62.53 111.139 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 140.76 -68.33 0.48 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.693 -0.765 . . . . 44.35 112.435 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 480' ' ' GLY . . . . . 0.465 ' O ' HG23 ' A' ' 558' ' ' VAL . . . 166.23 149.88 6.11 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.742 -0.742 . . . . 74.1 112.481 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 481' ' ' THR . . . . . 0.403 ' OG1' HG23 ' A' ' 557' ' ' THR . 95.6 m -130.04 112.59 13.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.792 0.33 . . . . 54.53 111.135 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.529 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -94.95 143.89 26.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 64.43 111.085 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -131.44 116.41 17.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 74.0 110.916 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.616 HG22 ' CD ' ' A' ' 524' ' ' GLU . 0.2 OUTLIER -98.1 112.48 24.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.124 -0.489 . . . . 55.31 111.13 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.459 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -134.78 147.8 50.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 35.34 110.967 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.446 ' NH2' HG21 ' A' ' 519' ' ' THR . 6.8 ttt180 -93.17 136.23 33.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.455 . . . . 65.34 110.883 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -139.67 161.86 36.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 54.53 111.105 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 488' ' ' GLU . . . . . 0.572 ' HG2' HG23 ' A' ' 491' ' ' VAL . 5.2 pm0 -51.98 156.87 2.35 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.685 0.755 . . . . 73.44 110.879 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -8.82 24.57 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.65 2.234 . . . . 73.22 112.339 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -82.43 -42.4 18.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 75.35 110.881 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.572 HG23 ' HG2' ' A' ' 488' ' ' GLU . 97.7 t -64.16 124.09 18.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 51.22 111.14 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -120.55 177.42 5.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.203 -0.453 . . . . 74.22 110.865 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.683 HG13 ' HB ' ' A' ' 512' ' ' ILE . 47.7 t -51.46 -47.49 35.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 64.51 111.113 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -51.83 -41.65 61.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.23 110.852 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.9 m -70.79 -34.46 71.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 43.14 111.123 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.555 HD13 ' CG2' ' A' ' 512' ' ' ILE . 2.6 mt -67.2 -45.42 76.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 73.24 110.9 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 -69.89 -45.42 67.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 72.25 110.83 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -64.93 -31.94 73.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 72.05 110.9 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 499' ' ' PHE . . . . . 0.505 ' HZ ' HD22 ' A' ' 543' ' ' LEU . 36.9 t80 -75.17 -43.24 53.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 73.31 110.868 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 51.0 mt -63.48 -43.96 95.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.465 . . . . 72.44 110.885 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -71.71 -42.07 67.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 71.21 110.9 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.89 -49.0 78.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 71.24 110.868 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -66.24 -23.98 66.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.462 . . . . 72.21 110.896 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -18.67 18.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.706 -0.759 . . . . 74.54 112.472 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -67.52 160.25 73.42 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.682 0.753 . . . . 73.25 110.851 -179.815 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 101.7 0.94 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.671 2.247 . . . . 71.32 112.335 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -123.51 -33.06 0.84 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.719 -0.753 . . . . 41.41 112.496 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 20.5 pttt -61.52 -43.5 98.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.746 0.308 . . . . 73.13 110.911 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -83.38 -31.51 26.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 72.2 110.883 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.587 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -55.79 172.06 0.19 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 42.4 111.114 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.6 t -126.93 111.09 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 72.14 111.109 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.683 ' HB ' HG13 ' A' ' 493' ' ' VAL . 34.5 mt -92.28 142.45 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 52.44 111.147 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.53 134.83 36.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 74.35 111.157 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -91.52 142.76 27.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 62.52 110.883 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 61.7 t -138.15 108.27 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 70.04 111.168 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -74.9 132.68 41.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.919 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.577 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -116.1 160.3 36.11 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.593 0.711 . . . . 42.42 111.099 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.577 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.79 74.45 1.3 Allowed 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.65 2.234 . . . . 64.21 112.358 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.446 HG21 ' NH2' ' A' ' 486' ' ' ARG . 3.0 t -179.83 141.77 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.254 -0.43 . . . . 64.14 111.16 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -101.04 29.02 4.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 73.45 111.142 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.6 -34.66 3.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 71.23 111.084 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -146.38 166.09 27.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.442 . . . . 71.4 110.929 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 19.8 mtm-85 -136.83 160.92 37.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 72.41 110.873 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 524' ' ' GLU . . . . . 0.616 ' CD ' HG22 ' A' ' 484' ' ' THR . 6.8 tp10 -93.94 140.21 29.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 70.35 110.903 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -130.8 132.42 45.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.115 -0.493 . . . . 73.44 110.907 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.614 HD23 HG23 ' A' ' 484' ' ' THR . 0.6 OUTLIER -112.99 107.05 15.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 73.23 110.904 -179.975 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.533 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.1 t -97.35 133.5 38.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 63.14 111.098 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.511 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 43.6 tttt -108.65 107.94 18.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 73.24 110.93 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.587 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -129.7 154.61 80.98 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.628 0.728 . . . . 75.12 110.89 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.28 42.67 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.716 2.278 . . . . 50.5 112.306 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 110.95 2.67 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.679 2.252 . . . . 64.03 112.361 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.6 mt -114.28 -170.99 1.83 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.429 . . . . 72.3 110.915 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.1 p -74.55 154.03 38.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 62.43 110.862 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -51.92 -40.62 61.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 70.32 110.839 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -61.25 -42.88 99.38 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.455 . . . . 73.42 110.926 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -63.34 -52.58 61.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 61.13 110.903 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -54.5 -52.95 60.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 62.32 110.845 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.36 -36.18 82.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 54.55 110.913 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -64.54 -49.84 69.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 72.01 110.903 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -62.53 -51.0 69.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 75.44 110.975 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -56.37 -47.71 78.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 70.53 110.891 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -59.87 -53.89 52.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 73.21 110.848 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 543' ' ' LEU . . . . . 0.505 HD22 ' HZ ' ' A' ' 499' ' ' PHE . 0.8 OUTLIER -52.66 -44.08 65.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 53.12 110.898 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.26 -56.46 21.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.44 110.887 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.14 -13.37 60.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 75.4 111.16 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 20.0 t -79.57 -57.54 3.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 71.42 110.829 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -88.38 -52.26 5.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 75.14 110.899 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.498 HD21 HG11 ' A' ' 491' ' ' VAL . 1.2 tp -67.76 -12.46 60.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.111 -0.495 . . . . 62.04 110.952 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 23.1 mmtp 57.16 23.46 8.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 65.52 110.893 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.32 178.39 1.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.454 . . . . 63.32 111.094 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 90.8 m -145.01 110.91 5.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 74.13 111.154 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 36.4 t -54.73 131.88 17.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 63.51 111.117 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 46.5 mt -115.18 -43.6 3.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 72.11 110.888 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -157.44 174.85 14.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 64.24 111.087 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 5.2 p -169.27 148.63 3.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 71.54 110.813 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -133.09 148.53 52.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.113 -0.494 . . . . 65.22 110.927 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 557' ' ' THR . . . . . 0.403 HG23 ' OG1' ' A' ' 481' ' ' THR . 3.9 m -138.97 145.48 39.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 60.14 111.149 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 558' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 480' ' ' GLY . 68.0 t -100.33 103.76 15.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.228 -0.442 . . . . 53.44 111.162 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.749 -0.739 . . . . 61.03 112.503 -179.99 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 17.7 ptt? . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.797 0.332 . . . . 74.33 110.921 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 16.7 m -133.99 169.57 21.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.433 . . . . 75.34 111.146 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 91.41 59.94 1.33 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.708 -0.758 . . . . 63.22 112.476 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -140.15 161.32 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.856 0.36 . . . . 73.12 110.864 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -171.36 126.13 0.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.31 110.884 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -133.76 147.19 51.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 75.24 110.947 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 2.9 p -132.19 142.3 49.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.107 -0.497 . . . . 72.12 110.862 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 475' ' ' ILE . . . . . 0.733 HG22 ' H ' ' A' ' 477' ' ' PHE . 26.7 mm -94.48 141.82 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 63.43 111.159 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.41 23.16 14.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 75.31 110.837 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.733 ' H ' HG22 ' A' ' 475' ' ' ILE . 7.1 t80 52.96 46.84 25.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 74.43 110.882 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 478' ' ' THR . . . . . 0.633 HG21 ' HG3' ' A' ' 531' ' ' PRO . 8.9 t -80.95 163.56 23.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 34.34 111.173 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -69.31 -54.54 12.91 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.72 -0.753 . . . . 54.34 112.475 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 137.91 179.2 16.78 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.756 -0.735 . . . . 40.35 112.544 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 33.2 m -125.19 108.35 11.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.788 0.328 . . . . 73.31 111.116 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.518 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -96.75 125.22 41.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 74.21 111.073 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -114.82 112.36 22.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 73.11 110.929 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.493 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.6 OUTLIER -95.41 112.92 24.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 43.3 111.166 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.469 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -134.01 143.2 47.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.246 -0.434 . . . . 64.25 110.924 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -89.27 142.58 27.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 71.4 110.842 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 487' ' ' ALA . . . . . 0.786 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -141.66 166.65 24.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.156 -0.475 . . . . 72.33 111.148 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -55.88 160.55 4.27 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.674 0.749 . . . . 73.35 110.876 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -17.67 37.19 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.632 2.222 . . . . 62.14 112.358 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -76.13 -40.45 52.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 71.34 110.955 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.466 HG11 HD21 ' A' ' 548' ' ' LEU . 82.7 t -59.22 137.33 21.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 72.22 111.091 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -133.65 175.65 9.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 60.23 110.904 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 85.1 t -51.92 -47.76 40.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.463 . . . . 61.42 111.146 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -54.12 -39.67 66.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 65.44 110.901 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 85.5 m -67.01 -43.13 83.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 74.31 111.143 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.698 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.4 mt -62.63 -51.08 68.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.45 . . . . 73.13 110.927 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -64.42 -36.28 83.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 74.12 110.897 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -63.95 -45.71 87.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 71.34 110.869 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -70.08 -36.13 74.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 74.42 110.856 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.597 HD12 HD11 ' A' ' 512' ' ' ILE . 43.4 mt -62.89 -52.93 61.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.166 -0.47 . . . . 71.03 110.947 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -68.71 -38.01 79.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.471 . . . . 75.32 110.852 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.88 -47.51 84.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.55 110.934 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -67.82 -25.08 65.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 74.54 110.908 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 113.96 -18.28 19.23 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.754 -0.736 . . . . 71.01 112.505 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -62.96 160.28 39.4 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.655 0.74 . . . . 72.43 110.867 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 91.31 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 65.42 112.303 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -108.76 -30.17 3.84 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.733 -0.746 . . . . 70.42 112.518 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -62.73 -51.96 65.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.768 0.318 . . . . 71.1 110.908 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -75.37 -29.89 60.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 72.24 110.918 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.618 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -57.43 168.66 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 50.54 111.119 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.01 111.13 24.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 72.2 111.109 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.698 HD13 ' HB3' ' A' ' 496' ' ' LEU . 53.8 mt -99.47 134.66 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.474 . . . . 74.14 111.14 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 4.0 m -134.68 155.24 50.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.182 -0.463 . . . . 70.03 111.105 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -102.85 143.99 31.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 74.03 110.922 179.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 515' ' ' VAL . . . . . 0.529 HG11 ' OE2' ' A' ' 524' ' ' GLU . 91.0 t -136.96 127.01 39.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 75.14 111.115 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -80.98 99.13 8.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 74.14 110.899 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.573 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -79.62 160.26 70.05 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.573 0.701 . . . . 54.11 111.081 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.573 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.2 Cg_endo -69.7 74.47 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.681 2.254 . . . . 73.41 112.365 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.561 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.1 t -177.32 139.23 0.25 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 73.42 111.151 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.0 24.98 6.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 50.33 111.105 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.19 -35.49 2.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 60.32 111.082 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.561 ' O ' HG23 ' A' ' 519' ' ' THR . 7.9 m-85 -136.83 161.41 36.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 72.51 110.891 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -123.75 155.56 37.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 72.4 110.895 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 524' ' ' GLU . . . . . 0.529 ' OE2' HG11 ' A' ' 515' ' ' VAL . 33.2 tt0 -90.55 144.46 25.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 72.02 110.887 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.786 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 90.4 m-85 -130.2 124.55 32.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 74.4 110.866 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.518 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -101.14 105.09 16.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.114 -0.494 . . . . 64.41 110.926 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.538 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.02 123.81 48.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 71.54 111.096 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.53 ' O ' HD23 ' A' ' 529' ' ' LEU . 18.2 tttp -102.68 108.56 19.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 73.54 110.904 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.618 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.4 mt -132.06 154.45 81.69 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.622 0.725 . . . . 74.52 110.89 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 162.14 43.2 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.682 2.254 . . . . 64.43 112.333 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 531' ' ' PRO . . . . . 0.633 ' HG3' HG21 ' A' ' 478' ' ' THR . 53.7 Cg_endo -69.81 107.28 1.83 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.676 2.251 . . . . 62.55 112.362 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 5.1 mt -109.85 -171.03 1.76 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.235 -0.439 . . . . 72.1 110.928 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.01 153.69 41.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 74.24 110.871 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -52.09 -45.86 65.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.146 -0.479 . . . . 74.03 110.867 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -60.05 -37.46 79.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.176 -0.466 . . . . 73.31 110.903 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -65.65 -57.47 8.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 72.0 110.849 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -53.25 -46.43 69.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 74.32 110.892 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -67.02 -38.8 86.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 73.43 110.96 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -64.08 -46.4 84.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 75.35 110.887 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.12 -51.06 63.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.48 . . . . 75.54 110.911 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -58.34 -49.05 78.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 73.2 110.896 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -58.76 -53.73 55.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 72.54 110.872 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.1 mt -52.75 -43.66 65.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 44.33 110.894 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.31 -56.39 22.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 64.32 110.898 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.58 -13.23 60.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 61.41 111.091 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.6 t -79.55 -56.84 4.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 64.02 110.873 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -88.37 -52.16 5.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 73.41 110.91 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.466 HD21 HG11 ' A' ' 491' ' ' VAL . 1.0 OUTLIER -67.96 -12.17 60.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 63.41 110.905 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt 57.57 23.46 9.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 72.24 110.877 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -64.58 -179.55 0.5 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 53.44 111.1 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 90.5 m -144.71 110.88 5.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 72.51 111.188 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.8 t -57.04 118.87 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 72.03 111.172 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 55.8 mt -99.75 -47.7 4.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 73.01 110.874 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.53 173.45 16.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 71.51 111.106 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 6.1 p -165.49 149.95 8.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 74.25 110.85 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -137.65 144.8 42.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.1 -0.5 . . . . 73.1 110.904 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 44.4 m -143.54 147.14 34.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 63.41 111.142 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 21.9 t -115.09 123.16 70.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.43 . . . . 72.33 111.074 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 32.41 112.503 179.991 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.86 0.362 . . . . 74.25 110.87 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 12.3 m -53.96 156.78 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 61.53 111.145 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 167.13 -99.86 0.16 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.739 -0.744 . . . . 51.03 112.488 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -78.89 136.4 37.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 75.25 110.916 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -95.32 121.7 37.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 44.24 110.906 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 41.9 p90 -140.76 154.32 46.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 74.22 110.928 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 22.1 t -167.63 172.71 9.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 63.31 110.874 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 2.7 pp -126.83 161.83 32.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 75.52 111.131 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 476' ' ' ASP . . . . . 0.575 ' OD1' HG22 ' A' ' 478' ' ' THR . 0.0 OUTLIER -106.32 -21.77 13.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 42.31 110.909 179.801 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.0 t80 62.0 28.43 17.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 73.23 110.847 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 478' ' ' THR . . . . . 0.575 HG22 ' OD1' ' A' ' 476' ' ' ASP . 11.8 t -98.53 30.32 3.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 65.14 111.108 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 175.43 -100.62 0.15 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.751 -0.737 . . . . 61.22 112.513 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 137.55 171.38 12.17 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.704 -0.76 . . . . 72.14 112.482 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 481' ' ' THR . . . . . 0.409 HG23 ' O ' ' A' ' 556' ' ' GLU . 7.1 m -122.84 107.54 11.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.776 0.322 . . . . 62.32 111.141 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.3 130.09 42.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 54.12 111.128 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -120.32 110.53 16.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 74.5 110.902 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.8 m -94.26 111.35 23.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 74.34 111.18 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.495 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -130.31 143.16 50.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 70.33 110.962 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.516 ' HB2' HD11 ' A' ' 553' ' ' LEU . 12.1 ttt180 -89.67 148.02 23.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 73.51 110.828 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 487' ' ' ALA . . . . . 0.737 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -153.35 169.64 22.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 74.24 111.102 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -62.6 160.54 34.06 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.646 0.736 . . . . 63.34 110.9 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -17.6 37.37 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.67 2.247 . . . . 65.34 112.358 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 38.8 m-20 -69.18 -45.73 69.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 72.43 110.913 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.522 HG11 HD21 ' A' ' 548' ' ' LEU . 42.7 t -65.22 129.56 29.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 71.22 111.127 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -124.16 177.29 5.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.21 110.886 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.458 HG13 ' HB ' ' A' ' 512' ' ' ILE . 93.8 t -51.7 -48.07 37.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 71.31 111.137 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -52.02 -41.05 61.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 74.45 110.899 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 95.4 m -68.95 -39.55 79.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 62.02 111.145 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.743 ' HB3' HD13 ' A' ' 512' ' ' ILE . 10.2 mt -64.03 -51.08 65.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 54.42 110.916 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -65.09 -40.95 95.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 75.43 110.85 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -61.34 -43.27 99.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 64.42 110.828 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -70.51 -37.75 74.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 73.32 110.932 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.569 HD12 HD11 ' A' ' 512' ' ' ILE . 33.9 mt -61.33 -51.82 67.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 71.13 110.89 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -69.62 -37.98 77.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 74.41 110.879 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -57.39 -48.96 77.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.485 . . . . 61.31 110.897 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.666 ' NZ ' HD22 ' A' ' 543' ' ' LEU . 17.2 mmtp -67.36 -24.05 65.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.191 -0.459 . . . . 63.03 110.89 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.1 -18.3 18.85 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.725 -0.75 . . . . 53.15 112.473 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.406 ' CD2' HD22 ' A' ' 540' ' ' LEU . 18.5 m-85 -64.54 160.21 53.98 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.682 0.753 . . . . 73.44 110.844 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 96.06 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.689 2.259 . . . . 63.03 112.357 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.76 -41.23 0.94 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.746 -0.74 . . . . 75.22 112.506 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -40.28 84.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.71 0.291 . . . . 74.44 110.877 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -83.75 -26.37 29.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 73.21 110.896 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.614 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -66.28 173.17 3.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 62.55 111.108 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.02 113.01 30.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 74.42 111.129 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.743 HD13 ' HB3' ' A' ' 496' ' ' LEU . 46.6 mt -102.29 132.96 47.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 62.23 111.096 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -127.76 141.77 51.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.14 -0.482 . . . . 71.24 111.154 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -92.92 126.15 37.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.266 -0.424 . . . . 74.14 110.921 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 92.8 t -116.35 99.22 7.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 62.23 111.118 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.24 113.71 10.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 64.34 110.892 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -94.3 160.31 32.17 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.588 0.709 . . . . 63.43 111.091 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.2 Cg_endo -69.82 74.53 1.31 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.687 2.258 . . . . 63.1 112.305 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.5 t -177.0 137.17 0.23 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 52.34 111.171 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.77 28.1 3.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 74.4 111.116 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.43 -34.66 3.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 73.42 111.06 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.544 ' O ' HG23 ' A' ' 519' ' ' THR . 15.4 m-85 -147.97 166.37 27.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.417 . . . . 54.31 110.872 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -140.35 159.67 41.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 71.53 110.868 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 524' ' ' GLU . . . . . 0.424 ' HG2' HD12 ' A' ' 553' ' ' LEU . 9.3 mt-10 -93.24 141.47 28.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 34.43 110.881 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.737 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 94.4 m-85 -127.31 124.34 38.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 73.32 110.869 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.23 111.58 23.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.121 -0.491 . . . . 71.1 110.936 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.557 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.5 t -104.17 117.0 49.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 64.13 111.094 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.56 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 5.3 ttmm -97.87 109.3 22.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.899 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.614 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.5 mt -131.71 154.38 81.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.657 0.741 . . . . 72.25 110.893 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 162.17 43.11 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.661 2.241 . . . . 72.43 112.352 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 105.28 1.47 Allowed 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.648 2.232 . . . . 73.3 112.361 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.7 mt -107.32 -171.06 1.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 74.1 110.937 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 46.4 t -71.18 151.24 44.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 52.51 110.862 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.93 -47.54 64.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 75.54 110.877 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -58.38 -41.05 83.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.162 -0.472 . . . . 73.12 110.913 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -64.44 -53.32 50.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 61.23 110.894 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 8.9 mtt85 -53.28 -52.99 57.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 73.13 110.908 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.2 mt -63.85 -34.42 77.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.183 -0.462 . . . . 73.43 110.894 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -65.86 -46.79 77.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 73.03 110.9 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.406 HD22 ' CD2' ' A' ' 505' ' ' PHE . 26.3 tp -64.86 -51.09 63.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.133 -0.485 . . . . 75.31 110.913 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -56.68 -49.39 75.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.455 . . . . 55.43 110.885 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -58.0 -53.41 58.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.462 . . . . 74.5 110.898 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 543' ' ' LEU . . . . . 0.666 HD22 ' NZ ' ' A' ' 503' ' ' LYS . 9.3 mt -52.79 -43.27 65.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 71.1 110.912 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.55 -56.51 20.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 72.02 110.88 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.58 -13.23 60.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.119 -0.492 . . . . 61.25 111.073 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 23.2 t -79.55 -56.96 3.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 74.05 110.87 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -88.33 -52.2 5.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 64.14 110.875 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.522 HD21 HG11 ' A' ' 491' ' ' VAL . 1.9 tp -67.9 -12.28 60.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.129 -0.487 . . . . 70.44 110.893 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt 57.58 23.32 9.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 73.11 110.903 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -65.3 -179.73 0.64 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.437 . . . . 60.34 111.092 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 86.2 m -145.12 110.94 5.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.1 111.146 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 62.1 t -57.59 126.76 15.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 75.43 111.122 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 553' ' ' LEU . . . . . 0.516 HD11 ' HB2' ' A' ' 486' ' ' ARG . 82.5 mt -110.72 -48.21 3.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 71.53 110.923 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -144.27 168.89 18.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 61.33 111.133 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 84.5 p -169.48 143.67 2.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 55.04 110.893 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.409 ' O ' HG23 ' A' ' 481' ' ' THR . 18.9 mt-10 -136.38 143.23 43.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 64.33 110.883 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 44.8 m -135.66 146.55 47.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 71.41 111.131 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 35.8 t -121.77 97.0 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 55.23 111.158 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 C-N-CA 120.734 -0.746 . . . . 65.2 112.499 179.982 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 9.7 mtm . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.813 0.339 . . . . 71.11 110.887 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 34.9 m -121.9 160.12 23.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 44.32 111.156 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -103.48 -168.94 25.64 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.728 -0.749 . . . . 72.13 112.469 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -164.36 132.72 3.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.865 0.364 . . . . 75.13 110.866 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -171.09 153.5 3.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 55.34 110.861 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -167.67 145.9 4.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 75.33 110.943 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 84.6 p -168.81 131.2 1.3 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 74.43 110.888 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -123.44 154.22 29.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 64.34 111.138 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -161.72 110.45 1.5 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.475 . . . . 62.44 110.858 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -55.19 102.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 75.23 110.857 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 12.0 t -148.76 166.21 29.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.114 -0.494 . . . . 71.44 111.148 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 479' ' ' GLY . . . . . 0.588 ' HA3' HG21 ' A' ' 558' ' ' VAL . . . -68.7 -60.36 5.42 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.77 -0.729 . . . . 52.35 112.51 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 133.72 161.41 9.68 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.731 -0.747 . . . . 51.4 112.47 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 481' ' ' THR . . . . . 0.625 ' OG1' HG23 ' A' ' 557' ' ' THR . 93.2 m -119.4 113.35 20.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 74.44 111.161 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.715 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -98.2 123.2 42.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 64.34 111.127 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -111.48 112.35 24.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 71.34 110.92 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.501 HG23 HD22 ' A' ' 526' ' ' LEU . 0.8 OUTLIER -96.45 111.48 23.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.112 -0.495 . . . . 75.03 111.144 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.485 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -130.04 142.93 50.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 75.23 110.945 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.6 135.79 35.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 61.01 110.863 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -144.37 170.88 15.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 60.31 111.044 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -62.32 160.55 31.68 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.671 0.748 . . . . 74.21 110.87 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -19.7 35.76 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.717 2.278 . . . . 64.23 112.337 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -64.99 -46.85 79.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 75.32 110.904 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.404 HG11 HD21 ' A' ' 548' ' ' LEU . 54.1 t -64.32 121.79 14.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 73.42 111.122 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -117.28 177.26 4.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 54.1 110.91 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 83.3 t -52.15 -48.47 42.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 74.42 111.153 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -52.35 -43.88 64.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 62.33 110.87 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 38.6 m -66.84 -41.96 86.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.48 . . . . 74.25 111.171 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.778 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.7 mt -63.57 -50.88 67.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 72.4 110.956 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 27.6 ptt180 -64.64 -35.96 82.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 65.12 110.89 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -64.7 -45.57 86.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.169 -0.469 . . . . 61.13 110.843 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -70.03 -35.98 74.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 74.41 110.902 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.84 HD12 HD11 ' A' ' 512' ' ' ILE . 26.4 mt -63.6 -52.79 59.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 74.5 110.929 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -68.23 -38.0 81.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 64.44 110.891 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.22 -45.76 92.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 71.4 110.868 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -68.57 -23.68 64.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 75.01 110.87 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.08 -19.07 18.24 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.694 -0.765 . . . . 22.51 112.475 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.546 ' CD2' HD22 ' A' ' 540' ' ' LEU . 15.5 m-85 -64.7 160.24 55.16 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.648 0.737 . . . . 70.1 110.86 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 97.43 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.705 2.27 . . . . 71.43 112.34 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -111.56 -35.03 1.96 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.728 -0.749 . . . . 72.51 112.474 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -64.66 -51.88 60.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.736 0.303 . . . . 73.53 110.906 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -71.66 -33.24 68.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 63.41 110.851 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.651 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -64.44 170.83 3.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.169 -0.469 . . . . 72.4 111.082 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.0 111.67 26.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 52.22 111.162 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.84 HD11 HD12 ' A' ' 500' ' ' LEU . 44.4 mt -97.53 119.89 46.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 72.32 111.164 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.24 155.43 27.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 73.24 111.128 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -114.71 142.24 46.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 54.32 110.902 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 61.8 t -134.55 113.42 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 72.21 111.156 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.19 102.18 1.63 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.135 -0.484 . . . . 70.34 110.887 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.578 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -74.0 160.27 82.15 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.616 0.722 . . . . 71.12 111.091 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.578 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.83 74.6 1.31 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.661 2.241 . . . . 75.42 112.335 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t 179.59 141.45 0.13 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 60.44 111.14 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -96.03 26.64 4.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 53.55 111.095 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.56 -35.06 3.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 71.44 111.083 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -140.03 178.57 7.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.441 . . . . 70.15 110.91 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 47.8 mtm180 -149.73 157.23 43.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 72.21 110.875 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -94.1 152.65 18.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 73.24 110.875 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.465 ' O ' HD23 ' A' ' 485' ' ' LEU . 80.7 m-85 -139.76 129.72 24.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 63.44 110.873 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.715 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -103.41 109.01 20.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.186 -0.461 . . . . 74.24 110.944 179.973 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.522 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.09 115.47 35.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 71.51 111.137 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.582 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 30.1 tttm -94.97 107.44 19.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.158 -0.474 . . . . 63.24 110.895 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.651 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -132.36 154.29 81.53 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.625 0.726 . . . . 72.31 110.934 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 162.12 43.31 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.704 2.269 . . . . 64.42 112.35 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 104.16 1.29 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.664 2.243 . . . . 72.24 112.326 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.2 mt -104.36 -171.3 1.9 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 73.05 110.943 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 30.5 m -70.24 150.87 45.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 72.22 110.841 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -52.29 -47.32 65.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 61.24 110.858 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -60.91 -49.95 75.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 45.21 110.878 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -55.24 -55.5 30.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 71.14 110.834 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 71.8 mtp180 -53.2 -52.99 57.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.467 . . . . 72.44 110.894 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 -35.2 72.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.191 -0.459 . . . . 74.32 110.907 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -65.92 -45.63 81.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 71.51 110.868 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.546 HD22 ' CD2' ' A' ' 505' ' ' PHE . 22.8 tp -63.38 -51.07 67.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.114 -0.494 . . . . 73.13 110.912 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -57.36 -50.02 74.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 75.21 110.893 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -57.96 -53.5 57.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.467 . . . . 65.13 110.853 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 543' ' ' LEU . . . . . 0.46 ' O ' HD23 ' A' ' 543' ' ' LEU . 2.0 tt -52.68 -43.23 65.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 71.11 110.898 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.66 -56.54 20.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 73.44 110.876 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.36 -13.32 60.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 63.32 111.09 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 25.1 t -79.64 -57.29 3.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 62.31 110.85 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -88.33 -52.29 5.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 52.12 110.912 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.404 HD21 HG11 ' A' ' 491' ' ' VAL . 0.4 OUTLIER -67.77 -12.44 60.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 72.45 110.966 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm 57.49 23.26 8.92 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.461 . . . . 62.11 110.882 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.29 178.7 1.43 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 63.22 111.142 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 42.4 m -143.89 110.98 5.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 55.12 111.144 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.9 t -58.18 104.01 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 74.22 111.145 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 25.1 mt -81.49 -39.08 25.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 71.21 110.926 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.59 173.2 13.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 74.45 111.083 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 1.3 t -166.06 155.81 12.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 72.04 110.87 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.566 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 7.0 pt-20 -149.55 141.69 24.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.47 . . . . 64.22 110.884 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 557' ' ' THR . . . . . 0.625 HG23 ' OG1' ' A' ' 481' ' ' THR . 27.7 m -141.31 145.72 35.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 74.04 111.151 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 558' ' ' VAL . . . . . 0.588 HG21 ' HA3' ' A' ' 479' ' ' GLY . 24.1 t -98.82 109.69 24.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 64.24 111.129 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 C-N-CA 120.721 -0.752 . . . . 50.45 112.472 179.946 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 23.2 mtt . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.784 0.326 . . . . 62.32 110.897 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 22.5 m -116.98 139.86 42.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 72.51 111.133 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 136.85 -106.0 0.53 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.695 -0.764 . . . . 74.5 112.472 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 55.02 31.73 16.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.901 0.381 . . . . 74.13 110.895 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -111.71 62.94 0.62 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 73.32 110.913 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -115.14 104.57 11.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 73.41 110.898 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 5.2 m -129.36 125.26 36.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 71.03 110.87 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 62.9 mt -96.18 145.28 8.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 72.35 111.122 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -114.87 -21.7 9.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.485 . . . . 74.51 110.897 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.489 ' CD2' HG22 ' A' ' 478' ' ' THR . 27.2 t80 -122.28 -72.28 0.69 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.117 -0.492 . . . . 74.33 110.846 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 478' ' ' THR . . . . . 0.489 HG22 ' CD2' ' A' ' 477' ' ' PHE . 14.6 t -161.92 173.37 14.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 72.21 111.113 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 145.86 110.21 0.65 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.706 -0.759 . . . . 43.42 112.465 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -135.36 160.85 24.56 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.759 -0.734 . . . . 51.42 112.503 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 92.1 m -122.04 110.72 16.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.8 0.333 . . . . 73.34 111.168 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.836 ' HB1' HD21 ' A' ' 526' ' ' LEU . . . -94.6 142.6 27.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 70.42 111.069 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -133.89 108.92 8.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 72.41 110.899 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.58 ' OG1' HD23 ' A' ' 526' ' ' LEU . 2.5 m -93.96 119.19 32.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 72.51 111.185 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.426 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.3 pt? -131.3 156.55 45.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 74.15 110.93 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -106.17 150.07 26.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 71.52 110.839 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -157.31 171.69 19.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 51.32 111.088 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.24 160.6 56.57 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.653 0.739 . . . . 72.42 110.881 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 -15.23 36.72 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.663 2.242 . . . . 53.22 112.338 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -62.82 -50.74 69.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.219 -0.446 . . . . 72.43 110.872 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.36 148.64 6.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 43.32 111.112 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -137.32 172.97 12.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.484 . . . . 73.45 110.875 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.429 HG22 ' HE2' ' A' ' 525' ' ' PHE . 87.2 t -51.41 -50.01 29.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 64.14 111.1 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -53.27 -40.39 64.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 73.44 110.918 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.4 m -68.36 -41.4 80.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 53.21 111.106 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.668 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.6 mt -60.51 -51.24 70.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.243 -0.435 . . . . 72.12 110.921 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -64.73 -42.95 94.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 74.41 110.902 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -59.85 -38.05 81.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.466 . . . . 75.25 110.835 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 499' ' ' PHE . . . . . 0.522 ' HE1' HD22 ' A' ' 543' ' ' LEU . 9.4 t80 -72.04 -44.61 63.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 73.13 110.863 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 40.1 mt -57.02 -48.89 77.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.464 . . . . 72.13 110.939 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -71.5 -37.99 71.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 75.14 110.88 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -55.28 -49.19 72.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 64.03 110.868 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.35 -25.92 67.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.468 . . . . 61.34 110.939 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 112.44 -7.29 26.5 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.748 -0.739 . . . . 62.21 112.495 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.615 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.6 m-85 -71.45 160.31 82.95 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.656 0.741 . . . . 54.1 110.87 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 506' ' ' PRO . . . . . 0.514 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 54.0 Cg_endo -69.73 79.93 0.91 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.667 2.245 . . . . 65.35 112.368 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -95.81 -37.18 5.05 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.748 -0.739 . . . . 63.14 112.47 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 11.5 pttp -59.34 -43.62 92.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.771 0.319 . . . . 75.14 110.875 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -81.18 -33.31 33.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 73.25 110.846 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.595 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -54.87 169.64 0.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 61.22 111.107 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 34.0 t -127.11 110.83 23.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 74.43 111.144 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.668 HD13 ' HB3' ' A' ' 496' ' ' LEU . 56.5 mt -92.91 128.76 44.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 71.42 111.12 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.95 136.54 52.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 72.35 111.138 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -99.16 132.93 44.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 72.51 110.881 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 33.1 t -139.54 111.42 5.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 72.33 111.105 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.78 98.52 8.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 74.04 110.896 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.6 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -65.08 161.22 50.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.609 0.718 . . . . 74.21 111.112 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.6 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.72 71.13 1.52 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.699 2.266 . . . . 72.22 112.372 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.8 t 177.81 136.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 74.55 111.161 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -93.96 38.63 1.08 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 64.41 111.064 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -124.42 -35.28 2.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 73.44 111.092 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -139.85 177.26 8.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.277 -0.42 . . . . 74.54 110.906 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.45 152.65 44.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 63.54 110.911 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 524' ' ' GLU . . . . . 0.41 ' HG2' HD12 ' A' ' 553' ' ' LEU . 9.7 mt-10 -111.67 130.97 55.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 75.34 110.876 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.429 ' HE2' HG22 ' A' ' 493' ' ' VAL . 6.0 m-85 -132.93 135.41 45.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 71.2 110.87 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.836 HD21 ' HB1' ' A' ' 482' ' ' ALA . 2.6 tm? -103.92 112.22 25.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 64.3 110.893 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.796 HG12 HD21 ' A' ' 529' ' ' LEU . 14.5 t -95.28 111.08 25.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 71.3 111.141 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.474 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 14.1 tttm -87.76 115.18 25.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 72.12 110.904 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.796 HD21 HG12 ' A' ' 527' ' ' VAL . 6.1 mt -131.78 154.88 81.92 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.644 0.735 . . . . 73.21 110.899 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 530' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 529' ' ' LEU . 53.9 Cg_endo -69.71 162.73 40.92 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.707 2.271 . . . . 65.31 112.379 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 103.91 1.23 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.698 2.266 . . . . 70.35 112.392 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.0 mt -107.22 -170.96 1.79 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 73.51 110.935 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.3 t -71.83 150.43 44.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 64.12 110.874 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -48.92 64.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 64.54 110.904 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -60.55 -48.41 81.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 73.32 110.888 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 49.4 mmm-85 -54.47 -57.96 9.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 62.31 110.885 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -52.86 -52.58 56.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 62.34 110.908 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mt -56.36 -37.12 69.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 64.0 110.928 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -64.84 -46.16 83.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 64.23 110.872 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.615 HD22 ' CD2' ' A' ' 505' ' ' PHE . 24.9 tp -60.91 -51.13 70.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 74.14 110.907 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.36 -50.33 73.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 64.44 110.857 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -58.0 -51.88 67.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.14 110.867 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 543' ' ' LEU . . . . . 0.522 HD22 ' HE1' ' A' ' 499' ' ' PHE . 2.6 tt -52.83 -44.78 66.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.229 -0.441 . . . . 74.01 110.88 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -60.05 -56.42 21.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 71.42 110.898 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.23 -13.14 59.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 73.13 111.103 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 23.2 t -79.63 -57.77 3.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 75.31 110.803 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -88.42 -52.12 5.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.093 -0.503 . . . . 73.21 110.874 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.82 -12.51 60.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.32 110.912 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt 57.09 23.39 8.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.185 -0.462 . . . . 63.21 110.924 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -68.65 176.93 2.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 64.2 111.071 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.7 m -145.09 110.96 5.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 63.11 111.098 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.5 t -54.14 135.11 16.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 64.13 111.1 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 553' ' ' LEU . . . . . 0.41 HD12 ' HG2' ' A' ' 524' ' ' GLU . 77.6 mt -120.79 -47.64 2.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 55.04 110.877 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 554' ' ' ALA . . . . . 0.546 ' HB3' ' HB ' ' A' ' 484' ' ' THR . . . -133.88 165.84 24.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 65.12 111.069 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 80.3 p -171.69 138.48 1.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 53.41 110.84 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.558 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 6.0 pt-20 -140.91 139.7 34.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.33 110.888 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 88.7 m -124.95 146.04 49.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.41 111.141 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 22.0 t -134.84 123.7 41.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 75.51 111.1 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 C-N-CA 120.754 -0.736 . . . . 71.54 112.504 -179.978 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 2.9 mmt . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.812 0.339 . . . . 75.23 110.855 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 28.8 m -76.81 134.65 28.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 75.43 111.128 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -153.18 75.96 0.23 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.718 -0.753 . . . . 21.22 112.474 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -150.02 151.31 33.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.822 0.344 . . . . 71.54 110.943 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -129.4 144.3 51.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 74.1 110.869 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 25.2 p90 -148.01 135.72 20.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 73.14 110.921 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 20.0 m -120.64 121.46 38.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.116 -0.493 . . . . 42.52 110.827 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 41.6 mt -117.27 141.65 34.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 75.35 111.161 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -166.03 119.83 1.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 74.43 110.877 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 21.6 p90 -123.39 127.29 48.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 63.41 110.88 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 20.2 m -106.74 70.05 0.8 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.117 -0.492 . . . . 72.03 111.137 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 128.78 -83.26 0.33 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.74 -0.743 . . . . 72.22 112.51 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 138.1 153.75 6.34 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.723 -0.751 . . . . 60.14 112.476 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 94.4 m -128.72 110.26 12.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.746 0.308 . . . . 74.12 111.154 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.423 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -96.81 130.1 44.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 72.01 111.094 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -117.56 116.45 27.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.217 -0.447 . . . . 75.41 110.923 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -98.81 110.04 22.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 72.1 111.158 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.488 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.9 pt? -133.37 145.64 50.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 62.42 110.89 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -89.29 137.72 32.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 72.32 110.911 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 487' ' ' ALA . . . . . 0.575 ' HB3' ' CD2' ' A' ' 525' ' ' PHE . . . -133.27 167.09 21.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 74.23 111.097 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -65.35 160.61 57.32 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.667 0.746 . . . . 71.43 110.862 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -12.79 33.6 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 2.251 . . . . 51.02 112.334 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -81.78 -37.29 27.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 64.53 110.861 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 87.8 t -70.75 120.67 19.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 60.1 111.143 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -113.49 178.72 4.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 73.23 110.883 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 54.1 t -53.46 -48.66 57.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 70.23 111.146 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -51.88 -42.08 62.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 64.25 110.875 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 69.6 m -67.84 -39.97 83.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.476 . . . . 64.14 111.139 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.574 ' HB3' HD13 ' A' ' 512' ' ' ILE . 2.3 mt -61.87 -50.94 70.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 70.22 110.899 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -64.79 -42.21 95.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.459 . . . . 74.02 110.859 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -60.04 -40.51 89.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.43 110.885 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 499' ' ' PHE . . . . . 0.563 ' HE1' HD22 ' A' ' 543' ' ' LEU . 15.0 t80 -70.9 -43.27 68.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 63.34 110.871 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 34.1 mt -57.78 -49.52 76.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 72.12 110.881 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.79 -37.96 73.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 71.41 110.872 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -56.38 -49.18 75.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 71.11 110.865 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -24.52 65.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 72.53 110.914 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -16.88 20.23 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.755 -0.736 . . . . 53.51 112.491 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.539 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.9 m-85 -60.94 160.24 21.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.658 0.742 . . . . 64.12 110.876 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 506' ' ' PRO . . . . . 0.498 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 53.7 Cg_endo -69.73 86.42 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.724 2.283 . . . . 60.34 112.333 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -102.04 -30.54 5.69 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.747 -0.739 . . . . 72.22 112.452 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -63.94 -42.22 97.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.766 0.317 . . . . 50.41 110.871 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -85.53 -27.19 25.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 73.0 110.854 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.626 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -62.34 165.6 5.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 62.44 111.104 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.83 111.28 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 73.5 111.092 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.574 HD13 ' HB3' ' A' ' 496' ' ' LEU . 54.3 mt -92.8 139.5 17.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 73.44 111.128 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -135.47 143.68 45.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 73.03 111.122 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -99.3 143.23 29.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 74.31 110.883 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 76.8 t -139.01 115.11 9.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.452 . . . . 62.33 111.119 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -74.63 127.3 32.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 63.55 110.868 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.586 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -110.41 160.22 29.25 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.563 0.697 . . . . 70.53 111.135 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.586 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.9 Cg_endo -69.76 74.48 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.692 2.262 . . . . 60.45 112.356 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.576 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.0 t 179.17 141.58 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.462 . . . . 73.34 111.122 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -99.56 27.41 5.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 63.02 111.089 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.48 -35.02 3.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 43.22 111.068 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.576 ' O ' HG23 ' A' ' 519' ' ' THR . 13.1 m-85 -146.8 159.98 42.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.275 -0.421 . . . . 73.51 110.943 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 4.6 ptt180 -131.18 165.02 24.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.09 -0.505 . . . . 74.03 110.867 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -92.84 139.94 30.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 64.02 110.869 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.575 ' CD2' ' HB3' ' A' ' 487' ' ' ALA . 10.8 m-85 -128.83 122.86 31.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.486 . . . . 71.41 110.851 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.41 HD22 ' HA ' ' A' ' 526' ' ' LEU . 0.5 OUTLIER -102.31 105.54 16.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.104 -0.498 . . . . 64.41 110.916 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.54 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.4 t -96.82 133.52 37.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 63.25 111.084 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.492 ' O ' HD23 ' A' ' 529' ' ' LEU . 18.9 tttp -108.55 108.1 18.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 61.44 110.929 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.626 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.6 mt -131.17 154.44 81.99 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.577 0.703 . . . . 75.52 110.898 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.16 43.14 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.678 2.252 . . . . 72.51 112.383 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 113.92 3.53 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.637 2.224 . . . . 74.41 112.354 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 1.2 mt -115.37 -171.19 1.91 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 60.0 110.907 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.32 154.98 38.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 62.13 110.848 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 534' ' ' ASP . . . . . 0.497 ' N ' HH21 ' A' ' 537' ' ' ARG . 4.6 m-20 -51.67 -47.11 63.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.101 -0.5 . . . . 70.11 110.855 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -59.78 -50.17 74.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 71.23 110.863 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -50.88 -59.11 4.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 71.44 110.897 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 537' ' ' ARG . . . . . 0.497 HH21 ' N ' ' A' ' 534' ' ' ASP . 79.4 mtm180 -53.51 -52.51 59.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 72.31 110.864 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.38 -39.32 67.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 73.24 110.931 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -67.23 -47.34 71.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.467 . . . . 72.43 110.879 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.539 HD22 ' CD2' ' A' ' 505' ' ' PHE . 21.7 tp -60.01 -51.09 71.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.14 110.92 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -59.47 -48.33 82.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 73.3 110.939 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 23.8 mtp180 -60.13 -53.52 56.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 73.51 110.869 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 543' ' ' LEU . . . . . 0.563 HD22 ' HE1' ' A' ' 499' ' ' PHE . 4.0 tt -52.9 -44.03 66.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 74.34 110.902 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.39 -56.48 20.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 73.34 110.875 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.36 -13.2 60.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 72.53 111.103 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.52 -57.34 3.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 72.41 110.898 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -88.33 -52.24 5.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.495 . . . . 71.11 110.914 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.1 tp -67.88 -12.35 60.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 33.13 110.945 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt 57.44 23.22 8.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 71.55 110.893 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.99 179.44 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 63.2 111.113 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 61.5 m -139.67 110.99 7.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 43.22 111.188 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.41 114.52 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 74.11 111.145 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 12.2 mt -90.92 -51.66 5.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 74.44 110.856 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -162.0 174.21 13.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 34.35 111.092 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 90.7 p -163.06 148.43 11.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 74.31 110.887 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.423 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 11.6 pt-20 -136.15 128.74 30.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 70.03 110.889 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 61.7 m -116.31 145.95 42.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.121 -0.49 . . . . 54.52 111.15 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 23.9 t -125.14 114.46 40.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 72.22 111.097 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.732 -0.747 . . . . 32.11 112.486 179.969 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.813 0.34 . . . . 72.43 110.85 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 11.5 p -81.26 -28.63 10.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 64.45 111.13 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 58.36 -150.58 33.54 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.722 -0.751 . . . . 63.3 112.477 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -127.5 158.79 36.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.899 0.381 . . . . 73.44 110.884 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -99.34 121.05 40.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 72.14 110.912 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -81.18 -175.39 5.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.22 -0.445 . . . . 74.14 110.958 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 8.4 m -138.45 115.15 10.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.147 -0.478 . . . . 73.22 110.86 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 475' ' ' ILE . . . . . 0.715 HG22 ' H ' ' A' ' 477' ' ' PHE . 28.4 mm -98.96 136.78 28.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.48 . . . . 34.3 111.122 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -77.89 -21.9 50.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 71.31 110.863 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.715 ' H ' HG22 ' A' ' 475' ' ' ILE . 41.5 p90 -110.46 175.09 5.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 74.22 110.907 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 92.0 m -160.83 143.72 12.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 72.32 111.129 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 176.26 -107.58 0.24 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.774 -0.727 . . . . 65.22 112.502 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -172.64 160.32 31.37 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.719 -0.753 . . . . 75.42 112.478 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 481' ' ' THR . . . . . 0.513 HG23 ' OG1' ' A' ' 557' ' ' THR . 25.6 m -131.6 107.35 8.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.8 0.333 . . . . 73.22 111.162 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.595 ' HB3' ' CG ' ' A' ' 556' ' ' GLU . . . -95.0 115.15 27.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 74.03 111.084 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -104.69 113.03 26.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 74.42 110.93 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 5.2 m -94.87 110.09 22.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.129 -0.487 . . . . 65.4 111.127 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.458 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -134.41 143.28 47.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 70.35 110.939 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.415 ' HD3' HD11 ' A' ' 553' ' ' LEU . 24.3 mtp180 -90.21 142.15 28.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 74.42 110.834 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 487' ' ' ALA . . . . . 0.485 ' HB3' ' CD2' ' A' ' 525' ' ' PHE . . . -137.15 168.54 19.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.172 -0.467 . . . . 73.13 111.065 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -63.94 160.57 45.67 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.617 0.722 . . . . 64.02 110.908 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -14.12 35.49 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.666 2.244 . . . . 75.43 112.322 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -80.17 -37.33 33.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 71.41 110.904 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 63.9 t -69.2 125.64 27.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.453 . . . . 74.12 111.169 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -117.99 175.35 5.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 43.21 110.873 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 60.9 t -51.79 -48.9 37.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 74.34 111.114 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -52.0 -40.38 60.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 54.15 110.918 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 95.2 m -66.47 -43.23 86.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.134 -0.485 . . . . 72.4 111.111 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.646 ' CB ' HD13 ' A' ' 512' ' ' ILE . 7.2 mt -61.78 -51.04 69.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 64.34 110.924 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -65.02 -35.09 80.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 72.54 110.841 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 42.6 mtp180 -64.19 -45.09 89.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.244 -0.435 . . . . 74.31 110.859 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -71.15 -36.92 72.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 71.22 110.9 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.456 HD12 HD11 ' A' ' 512' ' ' ILE . 29.2 mt -62.11 -50.43 71.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 71.11 110.962 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -71.08 -37.87 72.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 70.24 110.873 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.09 -48.95 78.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 73.45 110.905 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -67.88 -24.05 65.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 72.55 110.865 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 113.91 -18.6 19.11 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.745 -0.741 . . . . 63.01 112.472 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.511 ' CD2' HD22 ' A' ' 540' ' ' LEU . 15.9 m-85 -60.74 160.24 20.92 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.684 0.754 . . . . 62.53 110.884 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 506' ' ' PRO . . . . . 0.462 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 53.8 Cg_endo -69.77 90.08 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.683 2.255 . . . . 61.2 112.362 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -104.95 -39.26 2.35 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.788 -0.72 . . . . 34.44 112.501 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 17.1 mtpp -57.25 -52.08 66.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.728 0.299 . . . . 75.25 110.883 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.14 -36.27 66.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.426 . . . . 71.42 110.893 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.636 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -54.14 167.06 0.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 65.24 111.1 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.72 111.12 24.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 63.31 111.163 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.646 HD13 ' CB ' ' A' ' 496' ' ' LEU . 74.7 mt -96.02 127.05 48.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 62.13 111.141 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 2.1 m -122.13 148.21 45.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 61.44 111.193 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -104.41 140.35 38.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 72.34 110.925 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 80.8 t -136.43 111.91 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 65.04 111.177 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.09 110.93 7.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 74.33 110.924 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -91.51 160.25 37.16 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.547 0.689 . . . . 61.31 111.104 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.561 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.6 Cg_endo -69.79 74.55 1.29 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.673 2.249 . . . . 74.22 112.346 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.62 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.9 t -177.04 137.37 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 73.32 111.149 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.42 25.8 4.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 55.41 111.101 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.38 -35.15 3.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 62.01 111.072 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.62 ' O ' HG23 ' A' ' 519' ' ' THR . 13.4 m-85 -144.58 166.77 24.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 72.2 110.906 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -136.32 160.23 39.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.492 . . . . 72.11 110.853 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -88.97 138.39 31.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 51.33 110.906 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.485 ' CD2' ' HB3' ' A' ' 487' ' ' ALA . 10.9 m-85 -128.76 122.2 30.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 54.14 110.881 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.5 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -99.3 104.82 16.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 74.22 110.905 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.578 HG12 HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.57 111.86 27.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 71.23 111.112 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.509 ' O ' HD23 ' A' ' 529' ' ' LEU . 17.3 ttmt -91.38 109.05 20.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.15 110.86 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.636 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.0 mt -132.53 154.42 81.52 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.618 0.723 . . . . 74.35 110.921 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 162.19 43.04 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.714 2.276 . . . . 72.52 112.349 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 103.88 1.23 Allowed 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.684 2.256 . . . . 74.02 112.344 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 5.0 mt -101.06 -171.34 1.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 74.21 110.884 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 30.0 t -71.12 151.25 44.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 72.31 110.875 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -51.75 -51.14 58.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 63.02 110.873 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -61.14 -45.41 94.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.436 . . . . 71.3 110.924 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 11.6 mmt180 -57.38 -58.07 9.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 64.14 110.87 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -52.82 -52.15 58.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 72.31 110.908 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.4 mt -56.86 -48.12 78.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 71.43 110.9 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.8 -41.63 74.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 72.3 110.908 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.511 HD22 ' CD2' ' A' ' 505' ' ' PHE . 34.5 tp -66.38 -39.71 89.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.136 -0.484 . . . . 64.23 110.904 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -61.23 -55.4 32.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 74.45 110.836 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 1.6 ptt85 -59.07 -47.83 83.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 75.22 110.849 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 5.5 tt -53.59 -47.34 70.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.439 . . . . 75.41 110.898 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -60.63 -56.04 26.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 73.11 110.867 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.48 -14.09 55.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 63.03 111.138 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.03 -59.28 2.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 75.43 110.798 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -86.23 -52.55 5.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 74.43 110.87 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.44 HD23 ' HB2' ' A' ' 550' ' ' ALA . 1.2 tp -67.53 -12.67 60.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.456 . . . . 61.04 110.93 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.27 23.2 8.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 72.13 110.9 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 550' ' ' ALA . . . . . 0.44 ' HB2' HD23 ' A' ' 548' ' ' LEU . . . -68.68 175.4 3.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 71.41 111.075 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 88.9 m -137.55 111.18 8.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 64.51 111.148 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.2 111.81 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 73.44 111.167 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 553' ' ' LEU . . . . . 0.415 HD11 ' HD3' ' A' ' 486' ' ' ARG . 12.1 mt -90.15 -51.96 5.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 54.55 110.881 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.4 175.12 13.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 74.15 111.09 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 91.9 p -163.72 139.34 6.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 64.23 110.837 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.595 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 3.7 pt-20 -134.02 147.75 51.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 62.15 110.843 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 557' ' ' THR . . . . . 0.513 ' OG1' HG23 ' A' ' 481' ' ' THR . 63.1 m -142.9 139.69 30.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.091 -0.504 . . . . 44.1 111.126 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 23.6 t -102.6 116.02 45.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 74.24 111.139 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 C-N-CA 120.741 -0.742 . . . . 64.13 112.503 -179.989 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.828 0.347 . . . . 73.4 110.856 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 27.9 m -120.99 -177.15 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 74.55 111.124 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -149.23 90.91 0.14 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.754 -0.736 . . . . 64.43 112.48 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -130.75 98.82 4.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.876 0.369 . . . . 71.4 110.877 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -163.44 151.87 13.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 64.22 110.865 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -123.9 -176.22 3.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.22 -0.445 . . . . 72.12 110.914 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 4.1 t -90.78 168.5 11.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 74.3 110.88 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 475' ' ' ILE . . . . . 0.706 HG22 ' H ' ' A' ' 477' ' ' PHE . 29.5 mm -94.62 137.24 23.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 73.32 111.143 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -80.91 -21.51 40.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 71.44 110.82 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 477' ' ' PHE . . . . . 0.706 ' H ' HG22 ' A' ' 475' ' ' ILE . 74.5 m-85 -92.79 152.42 19.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 72.42 110.908 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 1.7 m -136.51 135.66 38.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 75.31 111.113 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -160.05 -106.46 0.22 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.797 -0.716 . . . . 73.23 112.508 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -159.95 148.31 16.62 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.766 -0.731 . . . . 52.33 112.498 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 1.6 m -123.94 109.21 13.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.776 0.322 . . . . 74.54 111.175 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 482' ' ' ALA . . . . . 0.74 ' HB3' ' CG ' ' A' ' 556' ' ' GLU . . . -94.87 121.98 37.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 32.43 111.103 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -115.95 114.6 24.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.439 . . . . 72.31 110.934 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.482 HG23 ' CD2' ' A' ' 526' ' ' LEU . 1.2 m -100.06 113.55 26.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.095 -0.502 . . . . 75.41 111.158 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.491 ' H ' HD23 ' A' ' 485' ' ' LEU . 1.8 pt? -131.64 143.86 50.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 75.34 110.861 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -92.14 145.25 24.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.467 . . . . 71.14 110.846 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -148.66 169.76 19.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 72.42 111.139 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -64.97 160.8 52.97 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.657 0.741 . . . . 74.34 110.925 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -10.74 29.3 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.691 2.261 . . . . 74.45 112.385 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -73.85 -46.45 44.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 71.54 110.853 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 491' ' ' VAL . . . . . 0.631 HG11 HD21 ' A' ' 548' ' ' LEU . 67.0 t -66.92 138.86 22.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.11 111.121 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -133.73 179.71 6.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 64.2 110.903 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.6 t -51.54 -47.93 36.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 71.32 111.093 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -51.65 -39.99 59.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.4 110.879 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.2 m -71.31 -35.53 71.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 64.54 111.141 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.66 ' CB ' HD13 ' A' ' 512' ' ' ILE . 4.1 mt -67.32 -45.57 76.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 71.22 110.898 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -69.47 -46.26 67.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 74.22 110.898 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -64.12 -32.47 74.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 73.32 110.891 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -73.28 -46.99 46.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 72.12 110.85 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 43.4 mt -61.08 -42.53 98.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 75.03 110.941 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -73.05 -37.59 66.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 60.55 110.891 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -60.34 -48.98 79.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 72.4 110.88 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 503' ' ' LYS . . . . . 0.596 ' HE2' HD13 ' A' ' 543' ' ' LEU . 28.8 mmmt -68.97 -23.78 64.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 72.34 110.875 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.12 -17.6 19.41 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.746 -0.74 . . . . 70.45 112.493 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -63.05 160.16 41.11 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.593 0.711 . . . . 71.25 110.943 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 95.57 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 122.689 2.259 . . . . 64.21 112.325 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -111.15 -37.24 1.68 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.695 -0.764 . . . . 52.43 112.482 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -63.34 -42.56 98.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.791 0.329 . . . . 64.43 110.874 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -79.91 -38.43 32.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 73.42 110.938 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.624 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -55.94 171.44 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 73.43 111.115 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 56.4 t -127.08 118.08 49.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.272 -0.422 . . . . 62.43 111.159 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.66 HD13 ' CB ' ' A' ' 496' ' ' LEU . 50.7 mt -96.82 141.84 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 74.33 111.151 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.89 138.72 37.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.13 111.173 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.53 143.17 27.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 53.11 110.956 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 83.7 t -135.77 104.61 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 75.23 111.11 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 18.9 tm0? -73.84 102.08 3.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 65.4 110.894 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -81.92 160.23 63.98 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.595 0.712 . . . . 75.12 111.089 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.78 74.55 1.29 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.629 2.22 . . . . 71.24 112.356 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 4.4 t -175.05 139.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 72.23 111.187 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.63 25.18 6.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 71.13 111.083 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.85 -34.57 3.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 42.21 111.11 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -138.6 177.61 7.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.242 -0.435 . . . . 74.21 110.944 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 44.2 mtt85 -144.78 153.66 41.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 75.51 110.875 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 524' ' ' GLU . . . . . 0.415 ' HG2' HD12 ' A' ' 553' ' ' LEU . 9.8 mt-10 -92.27 138.74 31.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 64.04 110.878 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.474 ' CD1' HD11 ' A' ' 496' ' ' LEU . 9.6 m-85 -122.25 122.77 39.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.138 -0.483 . . . . 70.33 110.868 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.482 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -100.46 101.48 12.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 71.0 110.944 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.565 ' CG1' HD21 ' A' ' 529' ' ' LEU . 19.7 t -95.98 122.7 47.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 55.01 111.128 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.531 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 0.1 OUTLIER -100.63 109.65 21.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.478 . . . . 73.32 110.874 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.624 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -130.77 154.65 81.9 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.583 0.706 . . . . 75.35 110.915 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 162.41 42.18 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.66 2.24 . . . . 62.04 112.379 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 104.04 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.667 2.245 . . . . 73.42 112.346 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.6 mt -103.0 -171.0 1.87 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 65.31 110.895 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 21.3 m -75.69 152.59 37.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 62.0 110.853 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.64 -46.77 63.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 75.24 110.918 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.03 -43.1 99.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 73.24 110.915 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -62.0 -55.8 25.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 75.34 110.877 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 45.9 mtp180 -52.79 -53.15 52.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 70.15 110.895 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 538' ' ' LEU . . . . . 0.567 HD22 HH21 ' A' ' 542' ' ' ARG . 0.8 OUTLIER -55.38 -48.3 74.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 73.53 110.975 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -55.55 -41.84 73.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.23 110.948 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 30.4 tp -66.0 -39.2 90.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.082 -0.508 . . . . 74.42 110.901 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -61.74 -55.63 28.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.185 -0.461 . . . . 75.41 110.919 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 542' ' ' ARG . . . . . 0.567 HH21 HD22 ' A' ' 538' ' ' LEU . 17.2 ptp180 -58.55 -47.95 82.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.096 -0.502 . . . . 64.1 110.89 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 543' ' ' LEU . . . . . 0.596 HD13 ' HE2' ' A' ' 503' ' ' LYS . 12.2 mt -53.72 -47.92 70.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.24 110.945 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -59.62 -56.26 24.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.166 -0.47 . . . . 74.22 110.877 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.06 -13.54 58.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 73.24 111.082 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -59.03 2.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.889 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -88.2 -52.22 5.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 70.03 110.896 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 548' ' ' LEU . . . . . 0.631 HD21 HG11 ' A' ' 491' ' ' VAL . 0.1 OUTLIER -67.63 -12.73 61.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 73.55 110.991 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt 55.89 24.22 7.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 50.01 110.942 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.81 -179.94 3.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.232 -0.44 . . . . 72.33 111.104 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.7 m -145.05 111.37 5.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 72.22 111.096 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.5 t -52.08 120.23 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 65.02 111.138 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 553' ' ' LEU . . . . . 0.415 HD12 ' HG2' ' A' ' 524' ' ' GLU . 16.0 mt -99.0 -50.91 4.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 72.2 110.88 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -159.11 174.71 14.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.447 . . . . 72.35 111.131 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 51.1 p -161.04 163.51 31.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 63.0 110.857 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 556' ' ' GLU . . . . . 0.74 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 18.5 pt-20 -155.26 136.38 13.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 73.22 110.88 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 2.6 m -130.05 144.27 51.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 51.42 111.157 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.68 111.95 35.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 71.23 111.112 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 C-N-CA 120.771 -0.728 . . . . 52.22 112.511 179.991 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 6.3 tpt . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.836 0.351 . . . . 70.21 110.89 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 20.3 m -80.95 159.48 4.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.248 -0.433 . . . . 73.44 111.147 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 170.64 78.74 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.748 -0.739 . . . . 74.52 112.471 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -111.79 99.03 7.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.882 0.373 . . . . 71.3 110.896 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -95.63 -48.33 5.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 74.43 110.919 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -145.27 159.61 42.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 74.53 110.909 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 11.1 p -147.69 120.3 8.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.124 -0.489 . . . . 54.23 110.832 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 34.8 mm -109.69 143.65 19.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 73.33 111.116 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -160.26 108.87 1.69 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 74.23 110.878 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -108.83 171.74 7.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 53.22 110.831 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 14.9 t -110.96 152.72 26.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.108 -0.496 . . . . 55.41 111.143 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 137.59 -86.28 0.23 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 64.14 112.501 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 130.8 146.42 5.88 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 54.35 112.471 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 9.3 m -125.17 113.65 17.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.811 0.339 . . . . 52.33 111.133 -179.868 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.06 121.18 36.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 65.12 111.096 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -114.01 110.18 19.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 70.31 110.921 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 484' ' ' THR . . . . . 0.488 HG23 HD22 ' A' ' 526' ' ' LEU . 1.5 m -97.77 120.21 37.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 64.15 111.123 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 485' ' ' LEU . . . . . 0.468 ' H ' HD23 ' A' ' 485' ' ' LEU . 2.1 pt? -136.96 153.2 50.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 55.14 110.888 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 486' ' ' ARG . . . . . 0.529 ' HB2' HD11 ' A' ' 553' ' ' LEU . 2.5 ttm180 -98.89 137.87 36.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.454 . . . . 63.44 110.864 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 487' ' ' ALA . . . . . 0.705 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -146.52 168.06 22.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 63.33 111.104 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.56 160.75 49.76 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.608 0.718 . . . . 63.24 110.9 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -15.86 37.08 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.653 2.235 . . . . 75.4 112.322 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -66.64 -47.48 72.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 74.03 110.847 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 38.7 t -67.87 129.63 32.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 64.33 111.123 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -122.6 177.77 5.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 72.23 110.844 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.582 HG13 ' HB ' ' A' ' 512' ' ' ILE . 87.1 t -51.5 -49.53 32.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 73.22 111.132 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -50.78 -40.36 54.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 73.53 110.841 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 91.5 m -70.57 -35.14 72.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 73.24 111.137 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 496' ' ' LEU . . . . . 0.514 ' CB ' HD13 ' A' ' 512' ' ' ILE . 4.5 mt -68.02 -44.19 77.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 73.01 110.887 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -69.39 -45.04 70.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 65.45 110.916 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -66.48 -32.78 74.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 74.44 110.876 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -73.6 -42.67 61.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 74.23 110.916 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 52.9 mt -65.53 -41.56 92.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 70.14 110.934 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -73.07 -37.76 66.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.13 110.88 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -64.02 -46.32 84.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 74.53 110.877 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -65.88 -24.76 66.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 73.22 110.941 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.01 -16.06 20.73 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.717 -0.754 . . . . 74.22 112.487 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 505' ' ' PHE . . . . . 0.416 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.2 m-85 -71.94 160.27 83.15 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.66 0.743 . . . . 73.52 110.877 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 98.44 0.69 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.676 2.25 . . . . 51.34 112.313 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -116.27 -34.59 1.31 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.779 -0.724 . . . . 43.32 112.495 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 3.7 mtmp? -62.39 -50.56 71.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.779 0.323 . . . . 72.35 110.907 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -73.02 -32.85 65.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 73.32 110.897 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 510' ' ' ALA . . . . . 0.618 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -59.75 172.94 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.138 -0.483 . . . . 51.41 111.097 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.03 119.37 52.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.225 -0.443 . . . . 74.23 111.145 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.582 ' HB ' HG13 ' A' ' 493' ' ' VAL . 44.2 mt -99.28 141.9 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 74.44 111.141 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.06 134.3 36.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 75.32 111.128 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 12.5 pm0 -94.89 142.74 27.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 72.2 110.949 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.8 t -138.21 114.33 10.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 74.34 111.183 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.08 113.01 10.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 75.1 110.88 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 517' ' ' ALA . . . . . 0.577 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -91.76 160.34 36.43 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.616 0.722 . . . . 54.44 111.055 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 518' ' ' PRO . . . . . 0.577 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.9 Cg_endo -69.75 74.43 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.673 2.249 . . . . 75.53 112.375 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 519' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 522' ' ' TYR . 3.0 t -179.32 141.02 0.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 72.45 111.145 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -97.33 24.76 6.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.253 -0.431 . . . . 44.44 111.125 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.63 -35.67 2.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 64.42 111.041 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 522' ' ' TYR . . . . . 0.56 ' O ' HG23 ' A' ' 519' ' ' THR . 7.4 m-85 -137.58 168.14 20.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 74.21 110.887 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 10.6 mmt85 -140.67 160.03 40.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.094 -0.503 . . . . 63.12 110.884 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -90.52 139.48 30.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 64.41 110.89 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 525' ' ' PHE . . . . . 0.705 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 89.9 m-85 -128.47 124.63 36.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.486 . . . . 61.21 110.859 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 526' ' ' LEU . . . . . 0.488 HD22 HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -106.35 104.31 13.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.465 . . . . 71.14 110.907 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.547 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.2 t -96.86 127.04 49.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 65.51 111.154 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 528' ' ' LYS . . . . . 0.592 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 3.1 tmtm? -106.44 108.32 19.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 54.21 110.885 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 529' ' ' LEU . . . . . 0.618 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.3 mt -130.58 154.73 81.76 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.631 0.729 . . . . 43.34 110.873 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 162.39 42.28 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.675 2.25 . . . . 65.44 112.331 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 104.05 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.701 2.267 . . . . 51.11 112.337 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.7 mt -103.78 -170.9 1.84 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 63.12 110.961 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 32.5 t -72.98 151.09 41.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 51.33 110.865 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.06 -46.31 65.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 44.31 110.82 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -61.11 -53.55 55.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 55.35 110.888 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 42.2 mmt180 -52.04 -55.79 18.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.458 . . . . 75.22 110.885 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 -52.93 -53.2 52.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 65.03 110.878 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.2 -39.8 70.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 74.14 110.933 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -64.21 -42.17 96.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.48 . . . . 74.54 110.885 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 540' ' ' LEU . . . . . 0.416 HD22 ' CD2' ' A' ' 505' ' ' PHE . 22.7 tp -64.01 -51.17 65.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 70.05 110.871 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 541' ' ' GLU . . . . . 0.434 ' OE1' HG22 ' A' ' 552' ' ' VAL . 62.6 mm-40 -57.28 -50.79 71.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 74.3 110.872 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -57.92 -52.52 65.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 74.33 110.881 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.5 mt -52.75 -43.5 65.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 72.12 110.925 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -60.86 -56.6 19.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 73.52 110.858 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.09 -13.45 60.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 74.22 111.091 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.7 -57.78 3.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.217 -0.447 . . . . 72.43 110.89 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -88.41 -52.32 5.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 62.41 110.863 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.71 -12.67 61.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 74.33 110.913 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 57.04 23.33 8.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 75.02 110.915 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -69.32 179.68 1.92 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 71.42 111.119 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 3.0 m -144.09 110.94 5.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 75.53 111.13 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 552' ' ' VAL . . . . . 0.434 HG22 ' OE1' ' A' ' 541' ' ' GLU . 39.2 t -53.64 115.59 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 65.23 111.092 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 553' ' ' LEU . . . . . 0.529 HD11 ' HB2' ' A' ' 486' ' ' ARG . 72.1 mt -92.51 -45.7 8.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 74.25 110.955 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.11 174.58 12.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 71.42 111.087 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 63.7 p -169.05 149.85 4.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 71.22 110.852 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -138.53 151.37 47.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 75.51 110.91 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 16.6 m -139.76 136.87 34.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 73.03 111.147 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 82.6 t -76.38 100.24 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 54.12 111.145 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 45.15 112.523 -179.999 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 N-CA-C 112.518 -0.233 . . . . 70.230000000000004 112.518 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 82.1 m -129.34 110.61 12.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.802 0.334 . . . . 73.140000000000001 111.175 -179.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.671 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -97.38 112.19 24.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 72.519999999999996 111.138 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -101.29 118.59 37.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 71.049999999999997 110.93 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.471 HG23 ' CD2' ' A' ' 526' ' ' LEU . 1.0 OUTLIER -101.44 112.84 25.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 65.109999999999999 111.149 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.484 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -132.6 142.91 49.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.256 -0.429 . . . . 61.5 110.922 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.42 146.02 24.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 70.099999999999994 110.875 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . 0.726 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -151.35 167.35 28.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 61.229999999999997 111.091 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -61.04 160.48 21.11 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.623 0.725 . . . . 73.329999999999998 110.875 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -23.61 30.6 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.689 2.259 . . . . 63.350000000000001 112.317 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 32.9 m-20 -63.56 -35.06 79.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 72.310000000000002 110.916 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 46.5 t -73.81 132.94 32.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.475 . . . . 75.209999999999994 111.136 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -127.88 177.67 6.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 74.340000000000003 110.879 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 91.1 t -51.72 -42.14 30.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 72.310000000000002 111.119 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -58.54 -41.21 85.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 73.540000000000006 110.892 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 34.8 m -66.31 -44.49 83.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 74.239999999999995 111.132 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.608 ' HB3' HD13 ' A' ' 512' ' ' ILE . 7.4 mt -62.03 -51.0 69.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 75.140000000000001 110.914 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -64.32 -34.83 79.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 75.0 110.858 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -64.71 -46.38 82.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 73.409999999999997 110.89 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -70.27 -35.41 73.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 72.430000000000007 110.839 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.714 HD12 HD11 ' A' ' 512' ' ' ILE . 36.4 mt -63.61 -52.81 59.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 74.319999999999993 110.922 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.78 -37.96 79.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 71.510000000000005 110.919 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -59.32 -48.27 82.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.487 . . . . 74.109999999999999 110.902 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -66.66 -24.85 66.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 73.109999999999999 110.897 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -18.35 18.99 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.74 -0.743 . . . . 75.25 112.505 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.505 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.8 m-85 -62.21 160.25 32.95 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.657 0.741 . . . . 75.340000000000003 110.894 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 90.3 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.653 2.235 . . . . 74.219999999999999 112.335 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -107.46 -26.08 5.79 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.702 -0.761 . . . . 61.119999999999997 112.478 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -68.05 -51.94 41.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 71.150000000000006 110.891 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -75.22 -33.9 61.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 61.32 110.867 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.625 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -55.92 170.56 0.29 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 31.530000000000001 111.093 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.01 113.35 32.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.232 -0.44 . . . . 73.439999999999998 111.101 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.714 HD11 HD12 ' A' ' 500' ' ' LEU . 57.9 mt -100.05 126.74 53.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 73.299999999999997 111.128 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -125.03 148.7 48.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 74.040000000000006 111.181 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -101.25 143.63 31.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 60.310000000000002 110.878 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 90.2 t -133.07 103.62 6.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 75.430000000000007 111.133 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -68.51 99.22 0.94 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 75.239999999999995 110.916 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.573 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -76.58 160.19 77.74 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.697 . . . . 74.530000000000001 111.07 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.573 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.74 74.5 1.27 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.696 2.264 . . . . 65.239999999999995 112.369 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 4.7 t -177.68 138.88 0.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.201 -0.454 . . . . 64.120000000000005 111.157 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.73 26.14 4.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.252 -0.431 . . . . 63.119999999999997 111.087 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.86 -35.23 3.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 71.530000000000001 111.13 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -141.08 177.15 8.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 74.430000000000007 110.914 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -147.76 154.01 39.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.072 -0.513 . . . . 75.25 110.847 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -89.02 145.94 25.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 71.329999999999998 110.936 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.726 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 96.3 m-85 -129.87 124.34 32.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 72.420000000000002 110.919 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.471 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.4 OUTLIER -102.64 105.87 16.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 63.039999999999999 110.906 -179.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.522 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.26 125.66 49.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 70.219999999999999 111.161 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.547 ' O ' HD23 ' A' ' 529' ' ' LEU . 6.0 ttmm -104.63 107.18 18.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 74.430000000000007 110.895 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.625 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.1 mt -132.3 154.54 81.64 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 73.040000000000006 110.897 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 162.08 43.48 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.686 2.257 . . . . 71.200000000000003 112.315 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 104.36 1.31 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.669 2.246 . . . . 44.409999999999997 112.338 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.0 mt -105.32 -171.07 1.85 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 70.140000000000001 110.944 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 9.3 t -72.35 153.12 41.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 73.519999999999996 110.883 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -52.08 -44.46 64.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 70.430000000000007 110.88 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -60.48 -38.97 85.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.246 -0.434 . . . . 65.200000000000003 110.933 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -66.05 -53.22 41.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 73.400000000000006 110.856 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 -55.52 -45.54 77.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 61.140000000000001 110.868 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mt -69.06 -38.88 79.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 64.019999999999996 110.957 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -63.75 -47.03 82.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 54.030000000000001 110.908 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.505 HD22 ' CD2' ' A' ' 505' ' ' PHE . 26.1 tp -66.1 -51.14 60.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 71.299999999999997 110.945 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -58.23 -49.78 75.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 75.200000000000003 110.913 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 8.3 mmt85 -58.39 -53.5 57.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 71.219999999999999 110.881 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 10.3 mt -52.7 -43.72 65.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.215 -0.448 . . . . 64.200000000000003 110.895 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.3 -56.48 21.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 73.219999999999999 110.889 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.46 -13.31 60.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 61.140000000000001 111.115 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 22.5 t -79.51 -56.97 3.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 74.239999999999995 110.894 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -88.38 -52.18 5.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 72.230000000000004 110.902 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.3 tp -67.86 -12.37 60.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.161 -0.472 . . . . 74.129999999999995 110.909 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 57.63 23.38 9.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.22 -0.445 . . . . 65.319999999999993 110.852 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -65.08 179.84 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 74.200000000000003 111.114 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 19.4 m -145.13 110.94 5.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 75.420000000000002 111.142 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.4 t -59.01 108.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 72.329999999999998 111.135 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 63.8 mt -89.71 -42.23 11.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 64.530000000000001 110.898 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -158.55 175.08 14.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 75.129999999999995 111.112 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 95.2 p -171.98 145.87 1.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 71.430000000000007 110.869 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.671 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 10.6 pt-20 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.099999999999994 110.861 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 N-CA-C 112.446 -0.262 . . . . 41.119999999999997 112.446 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 21.2 m -124.86 107.5 10.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.794 0.33 . . . . 62.119999999999997 111.161 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.732 ' HB3' ' CG ' ' A' ' 556' ' ' GLU . . . -94.98 114.09 25.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 52.25 111.083 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -106.1 117.38 33.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 62.200000000000003 110.965 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.474 HG23 HD22 ' A' ' 526' ' ' LEU . 0.6 OUTLIER -103.34 113.6 27.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 60.350000000000001 111.143 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.494 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.9 pt? -129.14 142.38 50.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 74.420000000000002 110.909 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -90.3 130.56 36.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 74.310000000000002 110.833 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . 0.659 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -133.94 169.42 17.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 74.129999999999995 111.127 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -60.49 160.55 17.88 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.652 0.739 . . . . 64.209999999999994 110.919 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -20.63 34.31 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.721 2.28 . . . . 72.010000000000005 112.302 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -67.97 -43.56 78.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 73.439999999999998 110.926 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.644 HG11 HD21 ' A' ' 548' ' ' LEU . 61.4 t -64.01 133.01 29.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.147 -0.479 . . . . 73.019999999999996 111.149 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -124.58 176.88 6.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 64.239999999999995 110.906 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 96.4 t -53.57 -50.02 52.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 75.230000000000004 111.108 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -52.05 -37.14 52.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 74.140000000000001 110.901 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 93.5 m -69.61 -41.83 75.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 64.209999999999994 111.188 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.64 ' CB ' HD13 ' A' ' 512' ' ' ILE . 8.0 mt -63.51 -49.83 72.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 75.299999999999997 110.956 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -65.87 -40.13 91.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 73.510000000000005 110.906 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -61.08 -45.48 94.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 74.519999999999996 110.878 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -69.5 -39.51 77.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 64.219999999999999 110.891 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.606 HD12 HD11 ' A' ' 512' ' ' ILE . 36.7 mt -58.86 -52.71 64.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 64.319999999999993 110.915 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -69.19 -37.96 78.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 75.439999999999998 110.873 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -56.18 -47.42 78.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 71.120000000000005 110.9 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -70.56 -22.71 62.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 71.540000000000006 110.913 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -17.86 19.43 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.739 -0.744 . . . . 53.210000000000001 112.519 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.75 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.3 m-85 -61.3 160.22 25.06 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.614 0.721 . . . . 74.329999999999998 110.883 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 93.2 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.671 2.247 . . . . 74.030000000000001 112.34 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.1 -38.12 1.28 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.699 -0.762 . . . . 64.140000000000001 112.434 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 7.9 pttt -60.53 -30.74 69.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.776 0.322 . . . . 51.200000000000003 110.906 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -95.52 -32.79 12.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.194 -0.457 . . . . 74.129999999999995 110.92 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.606 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -57.28 170.67 0.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 73.329999999999998 111.114 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 22.0 t -126.9 111.53 26.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 64.140000000000001 111.141 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.64 HD13 ' CB ' ' A' ' 496' ' ' LEU . 72.6 mt -100.53 137.48 27.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 65.430000000000007 111.108 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.76 138.48 39.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 74.120000000000005 111.118 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -83.96 140.48 31.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 53.210000000000001 110.893 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 67.6 t -131.82 100.38 4.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.192 -0.458 . . . . 72.299999999999997 111.125 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -67.53 112.1 4.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 54.109999999999999 110.915 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.582 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -94.51 160.26 31.99 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.619 0.723 . . . . 64.25 111.091 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.582 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.78 74.52 1.29 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.672 2.248 . . . . 72.230000000000004 112.374 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.631 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.0 t -176.43 137.48 0.28 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 62.530000000000001 111.096 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.4 25.15 4.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 61.119999999999997 111.087 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.99 -35.4 3.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 63.43 111.055 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.631 ' O ' HG23 ' A' ' 519' ' ' THR . 12.7 m-85 -143.16 170.89 14.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 71.439999999999998 110.874 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 60.5 mtt-85 -142.67 160.32 40.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 74.040000000000006 110.869 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -91.29 141.99 28.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 73.099999999999994 110.887 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.659 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 80.7 m-85 -127.86 120.31 27.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 71.340000000000003 110.867 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.474 HD22 HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -96.39 106.22 18.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 70.530000000000001 110.935 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.546 ' CG1' HD21 ' A' ' 529' ' ' LEU . 20.0 t -100.93 118.07 47.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 64.510000000000005 111.129 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.524 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 0.5 OUTLIER -96.6 107.45 19.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 74.25 110.91 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.606 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.3 mt -130.33 154.38 81.47 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.563 0.696 . . . . 61.520000000000003 110.93 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 162.15 43.2 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.675 2.25 . . . . 72.040000000000006 112.327 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 117.19 4.94 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.695 2.264 . . . . 61.25 112.299 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 2.5 mt -118.83 -170.96 2.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 74.230000000000004 110.91 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.1 t -67.23 148.16 52.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 74.200000000000003 110.844 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -51.91 -48.02 64.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 71.010000000000005 110.85 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -61.95 -44.53 96.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 62.530000000000001 110.86 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -61.07 -54.04 49.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.483 . . . . 73.120000000000005 110.903 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -54.14 -53.05 58.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.253 -0.431 . . . . 54.520000000000003 110.838 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -60.42 -40.0 89.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 70.329999999999998 110.902 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -63.25 -48.82 76.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 71.120000000000005 110.88 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.75 HD22 ' CD2' ' A' ' 505' ' ' PHE . 49.1 tp -59.01 -51.04 71.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 62.310000000000002 110.937 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -56.37 -48.81 76.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 74.340000000000003 110.892 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -63.82 -37.93 89.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 72.120000000000005 110.833 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 4.8 tt -60.27 -50.95 71.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 74.409999999999997 110.921 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . 0.508 ' CE2' HD11 ' A' ' 540' ' ' LEU . 12.2 m-85 -63.35 -50.56 69.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 72.340000000000003 110.837 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.504 ' HA ' ' HB3' ' A' ' 550' ' ' ALA . . . -61.12 -27.49 68.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 70.040000000000006 111.066 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.7 t -80.71 -62.73 1.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.253 -0.431 . . . . 64.409999999999997 110.818 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -64.62 -59.44 4.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 54.409999999999997 110.88 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.644 HD21 HG11 ' A' ' 491' ' ' VAL . 1.7 tp -68.93 -8.58 45.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.138 -0.483 . . . . 74.099999999999994 110.941 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.71 22.56 11.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 75.420000000000002 110.901 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . 0.504 ' HB3' ' HA ' ' A' ' 545' ' ' ALA . . . -73.84 179.6 4.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 50.310000000000002 111.091 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.5 m -145.05 110.95 5.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 55.530000000000001 111.101 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 46.9 t -52.11 112.48 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 53.420000000000002 111.131 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 13.4 mt -88.58 -51.95 5.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.149 -0.478 . . . . 42.340000000000003 110.932 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.55 173.78 15.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 75.329999999999998 111.047 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 95.2 p -160.7 145.41 14.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 63.409999999999997 110.84 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.732 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 9.4 pt-20 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.124 -0.489 . . . . 51.310000000000002 110.911 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 N-CA-C 112.461 -0.255 . . . . 51.009999999999998 112.461 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 20.1 m -128.91 109.35 11.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.751 0.31 . . . . 74.409999999999997 111.139 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -96.0 123.98 39.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 64.0 111.111 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -115.05 111.29 20.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.213 -0.449 . . . . 75.549999999999997 110.921 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.81 113.97 25.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.109 -0.496 . . . . 45.130000000000003 111.138 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.507 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.9 pt? -130.28 143.09 50.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 60.340000000000003 110.924 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.603 ' HB2' HD21 ' A' ' 553' ' ' LEU . 10.8 ttt180 -86.99 141.38 28.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 72.0 110.885 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . 0.738 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -149.47 160.64 43.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 64.340000000000003 111.137 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . 0.643 ' HG2' HG23 ' A' ' 491' ' ' VAL . 1.6 pm0 -51.72 156.85 2.16 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.658 0.742 . . . . 75.329999999999998 110.894 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 -9.24 25.63 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.712 2.275 . . . . 74.219999999999999 112.375 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -77.87 -44.66 26.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 71.5 110.918 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.643 HG23 ' HG2' ' A' ' 488' ' ' GLU . 97.4 t -56.34 124.29 9.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 74.519999999999996 111.153 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -116.67 171.41 7.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 70.239999999999995 110.898 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 91.5 t -51.71 -49.52 34.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 72.430000000000007 111.101 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -53.02 -40.17 63.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 72.430000000000007 110.932 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 89.5 m -66.91 -45.43 77.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 71.439999999999998 111.182 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.485 ' CB ' HD13 ' A' ' 512' ' ' ILE . 8.7 mt -61.58 -51.08 70.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.205 -0.452 . . . . 63.229999999999997 110.923 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . 0.488 ' HB3' HD12 ' A' ' 512' ' ' ILE . 9.4 ptm180 -63.5 -37.0 85.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 63.350000000000001 110.863 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 29.5 mtt85 -63.75 -44.29 93.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 73.25 110.895 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -70.25 -36.62 74.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 75.400000000000006 110.895 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.525 HD12 HD11 ' A' ' 512' ' ' ILE . 38.4 mt -63.04 -53.05 59.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 61.539999999999999 110.92 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -67.97 -38.36 82.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 72.299999999999997 110.88 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -58.52 -48.56 80.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.299999999999997 110.914 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -65.89 -25.07 67.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 71.420000000000002 110.896 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.04 -17.88 19.38 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.754 -0.736 . . . . 43.310000000000002 112.464 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.793 ' CD2' HD22 ' A' ' 540' ' ' LEU . 18.4 m-85 -62.18 160.21 32.96 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.65 0.738 . . . . 71.430000000000007 110.891 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 53.5 Cg_endo -69.75 88.29 0.54 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.691 2.261 . . . . 62.25 112.337 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -104.64 -28.36 5.71 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.783 -0.722 . . . . 55.109999999999999 112.513 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt -64.91 -52.02 58.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.744 0.307 . . . . 74.299999999999997 110.949 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -75.76 -26.11 57.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 63.509999999999998 110.868 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.611 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -63.55 167.32 5.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 52.299999999999997 111.084 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.92 112.83 30.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 62.299999999999997 111.108 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.525 HD11 HD12 ' A' ' 500' ' ' LEU . 43.6 mt -97.67 129.35 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 73.349999999999994 111.106 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -123.01 142.67 50.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 53.100000000000001 111.088 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -98.64 129.43 45.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 55.32 110.915 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 84.7 t -122.88 102.69 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.257 -0.429 . . . . 73.540000000000006 111.151 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.17 109.13 10.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.45 . . . . 64.409999999999997 110.935 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -88.46 160.31 45.25 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.584 0.707 . . . . 74.299999999999997 111.081 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.3 Cg_endo -69.76 74.48 1.29 Allowed 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.752 2.301 . . . . 75.129999999999995 112.315 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.503 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.6 t -176.54 137.02 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 64.310000000000002 111.154 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.68 28.64 2.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.435 . . . . 53.210000000000001 111.106 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.22 -34.74 3.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 54.420000000000002 111.088 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.503 ' O ' HG23 ' A' ' 519' ' ' THR . 13.8 m-85 -149.18 169.9 19.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 72.549999999999997 110.969 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 44.9 mtp180 -143.63 162.3 36.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 63.219999999999999 110.853 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -96.1 141.24 29.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 71.530000000000001 110.883 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.738 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 89.5 m-85 -128.54 124.31 35.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 71.5 110.878 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 526' ' ' LEU . 0.5 OUTLIER -99.53 110.01 22.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 72.150000000000006 110.943 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.536 HG12 HD21 ' A' ' 529' ' ' LEU . 21.5 t -101.71 116.73 45.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.459 . . . . 75.530000000000001 111.107 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.544 ' O ' HD23 ' A' ' 529' ' ' LEU . 26.1 tttt -96.5 108.25 20.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 71.019999999999996 110.881 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.611 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.5 mt -132.7 154.45 81.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.611 0.72 . . . . 75.530000000000001 110.903 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 162.09 43.43 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.726 2.284 . . . . 74.299999999999997 112.327 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 112.93 3.21 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.697 2.264 . . . . 63.439999999999998 112.302 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.5 mt -114.89 -172.68 2.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 62.32 110.921 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 31.6 m -64.32 149.34 48.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 62.109999999999999 110.88 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.94 -50.83 60.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.144 -0.48 . . . . 72.329999999999998 110.871 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -62.54 -37.19 85.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 74.230000000000004 110.853 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -64.49 -53.88 41.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 71.439999999999998 110.865 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -57.9 -51.11 70.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 74.519999999999996 110.82 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.7 -41.07 94.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.224 -0.444 . . . . 71.230000000000004 110.943 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -61.91 -47.36 85.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 64.349999999999994 110.884 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.793 HD22 ' CD2' ' A' ' 505' ' ' PHE . 29.6 tp -61.24 -51.1 70.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.188 -0.46 . . . . 71.230000000000004 110.961 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -55.52 -45.26 77.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 74.230000000000004 110.912 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 11.8 mtp85 -68.15 -38.68 82.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 71.510000000000005 110.902 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . 0.533 HD23 ' O ' ' A' ' 543' ' ' LEU . 4.9 tt -60.52 -41.94 95.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 44.32 110.93 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . 0.504 ' CE2' HD11 ' A' ' 540' ' ' LEU . 9.8 m-85 -72.16 -50.64 26.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 71.209999999999994 110.832 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . 0.471 ' HA ' ' HB3' ' A' ' 550' ' ' ALA . . . -61.47 -26.36 67.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 60.509999999999998 111.142 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 67.5 p -80.72 -62.67 1.6 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 71.340000000000003 110.908 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -65.98 -58.95 4.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.113 -0.494 . . . . 74.209999999999994 110.891 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.508 HD21 HG11 ' A' ' 491' ' ' VAL . 1.8 tp -68.92 -8.53 45.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.158 -0.473 . . . . 65.319999999999993 110.93 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt 64.61 22.84 12.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 62.43 110.883 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' A' ' 545' ' ' ALA . . . -72.32 178.46 3.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 65.099999999999994 111.077 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 63.3 m -145.03 110.91 5.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 72.209999999999994 111.111 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.2 t -52.15 123.63 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 74.150000000000006 111.156 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . 0.603 HD21 ' HB2' ' A' ' 486' ' ' ARG . 18.4 mt -103.78 -49.64 3.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 73.299999999999997 110.942 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -151.26 172.67 15.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 63.439999999999998 111.082 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 89.3 p -163.35 155.23 17.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 61.409999999999997 110.886 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 71.439999999999998 110.913 -179.959 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.518 -0.233 . . . . 63.109999999999999 112.518 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 34.0 m -131.5 110.71 11.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.76 0.314 . . . . 75.019999999999996 111.117 -179.848 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.48 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -96.59 119.73 35.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 60.140000000000001 111.147 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -110.43 113.77 26.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.995 0.426 . . . . 65.150000000000006 110.916 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.495 HG23 HD22 ' A' ' 526' ' ' LEU . 1.3 m -97.89 112.31 24.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.099 -0.501 . . . . 74.239999999999995 111.098 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.453 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.7 pt? -134.19 142.39 47.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 73.239999999999995 110.917 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -88.85 141.5 28.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 72.129999999999995 110.892 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . 0.697 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -140.4 160.95 38.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 72.329999999999998 111.102 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . 0.63 ' HG3' HG23 ' A' ' 491' ' ' VAL . 7.0 pt-20 -51.76 156.9 2.16 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.613 0.721 . . . . 74.109999999999999 110.89 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -9.14 25.37 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.686 2.257 . . . . 64.209999999999994 112.326 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -80.7 -43.08 20.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 73.219999999999999 110.82 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.63 HG23 ' HG3' ' A' ' 488' ' ' GLU . 72.1 t -65.69 134.19 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 75.010000000000005 111.116 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -125.81 175.88 7.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 61.109999999999999 110.903 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 60.6 t -51.65 -49.91 32.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 74.219999999999999 111.113 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -51.93 -41.46 62.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 63.210000000000001 110.899 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 88.4 m -67.91 -37.96 82.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.113 -0.494 . . . . 74.140000000000001 111.147 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.624 ' HB3' HD13 ' A' ' 512' ' ' ILE . 3.9 mt -64.94 -50.95 64.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 63.119999999999997 110.942 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 17.9 ptt85 -63.86 -42.94 97.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 62.310000000000002 110.855 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -61.66 -41.73 97.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.447 . . . . 73.420000000000002 110.862 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -69.46 -40.39 77.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 53.020000000000003 110.906 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.92 -51.77 67.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 72.540000000000006 110.936 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.87 -38.34 82.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 73.420000000000002 110.895 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -57.92 -48.84 78.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 61.210000000000001 110.901 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -67.67 -24.9 65.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 74.319999999999993 110.866 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -18.46 18.92 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.704 -0.76 . . . . 71.209999999999994 112.48 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.427 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.5 m-85 -65.35 160.27 59.96 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.705 0.765 . . . . 75.409999999999997 110.838 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 95.6 0.56 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.682 2.255 . . . . 64.25 112.334 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -112.3 -51.97 0.53 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.717 -0.754 . . . . 63.539999999999999 112.454 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -52.04 -51.56 56.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.713 0.292 . . . . 72.430000000000007 110.86 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -27.39 65.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 74.120000000000005 110.846 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.599 ' HB1' ' O ' ' A' ' 528' ' ' LYS . . . -68.61 175.26 3.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 74.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.02 111.11 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.466 . . . . 71.319999999999993 111.151 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.624 HD13 ' HB3' ' A' ' 496' ' ' LEU . 69.5 mt -97.45 140.92 16.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 75.409999999999997 111.119 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.5 m -136.16 147.46 47.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 62.329999999999998 111.175 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -98.72 143.62 28.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.221 -0.445 . . . . 74.129999999999995 110.933 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 60.0 t -139.0 111.01 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.182 -0.463 . . . . 72.530000000000001 111.122 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.66 113.42 15.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 75.299999999999997 110.897 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.589 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -95.06 160.27 31.25 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.571 0.7 . . . . 73.540000000000006 111.099 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.589 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.4 Cg_endo -69.74 74.56 1.27 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.707 2.271 . . . . 63.340000000000003 112.316 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.583 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.9 t -176.59 139.24 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 62.439999999999998 111.093 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.5 27.27 4.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 72.209999999999994 111.098 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.5 -34.94 3.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 53.32 111.12 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.583 ' O ' HG23 ' A' ' 519' ' ' THR . 12.5 m-85 -146.03 162.63 37.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.241 -0.436 . . . . 74.140000000000001 110.945 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 71.3 mtt-85 -130.37 160.93 32.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.095 -0.502 . . . . 72.019999999999996 110.904 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 63.7 tt0 -94.23 139.76 30.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 63.119999999999997 110.905 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.697 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 89.6 m-85 -127.85 124.64 38.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 74.519999999999996 110.905 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.495 HD22 HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -101.09 103.58 14.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.164 -0.471 . . . . 64.310000000000002 110.966 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.548 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.5 t -96.82 127.94 48.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 73.230000000000004 111.142 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.599 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 41.6 tttt -106.91 109.0 20.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 75.549999999999997 110.871 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.594 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.5 mt -130.6 154.39 81.7 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.587 0.708 . . . . 74.549999999999997 110.921 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 162.14 43.2 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.654 2.236 . . . . 72.239999999999995 112.31 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 109.63 2.37 Favored 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.697 2.264 . . . . 74.519999999999996 112.31 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.7 mt -111.54 -172.35 2.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 75.5 110.943 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.66 153.67 42.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 63.299999999999997 110.827 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -52.1 -46.35 65.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 74.25 110.826 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -60.34 -36.0 76.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 74.219999999999999 110.877 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -66.36 -56.62 10.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 74.109999999999999 110.861 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 -54.93 -44.84 74.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.461 . . . . 74.140000000000001 110.878 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.51 HD22 ' NE ' ' A' ' 542' ' ' ARG . 2.3 mt -67.9 -41.04 83.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 74.049999999999997 110.92 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.17 -46.83 85.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.21 -0.45 . . . . 75.530000000000001 110.919 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.427 HD22 ' CD2' ' A' ' 505' ' ' PHE . 23.9 tp -64.95 -51.15 63.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 71.420000000000002 110.931 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -58.47 -50.25 74.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 75.219999999999999 110.902 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . 0.51 ' NE ' HD22 ' A' ' 538' ' ' LEU . 96.8 mtt180 -58.45 -53.25 60.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 62.420000000000002 110.878 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 543' ' ' LEU . 5.7 tt -52.76 -43.48 65.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 74.109999999999999 110.897 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -60.68 -56.47 20.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.456 . . . . 74.150000000000006 110.915 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.32 -13.34 60.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 75.299999999999997 111.121 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.65 -57.27 3.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 63.310000000000002 110.85 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -88.36 -52.29 5.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 70.340000000000003 110.831 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.77 -12.37 60.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 72.209999999999994 110.916 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp 57.25 23.53 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 74.450000000000003 110.924 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.36 174.21 2.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 54.340000000000003 111.079 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 92.4 m -135.49 110.96 9.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.215 -0.448 . . . . 61.5 111.114 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.7 t -58.22 108.34 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 44.130000000000003 111.133 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 10.3 mt -84.49 -49.2 8.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 74.540000000000006 110.963 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -159.03 173.8 15.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.468 . . . . 73.230000000000004 111.144 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 93.8 p -165.57 139.32 4.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 62.420000000000002 110.848 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.48 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 1.2 pm0 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 72.200000000000003 110.877 -179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.29 0 N-CA-C 112.487 -0.245 . . . . 71.25 112.487 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 2.7 m -125.29 107.51 10.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.743 0.306 . . . . 51.530000000000001 111.128 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.0 116.58 28.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 52.409999999999997 111.107 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -105.95 114.21 28.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 74.209999999999994 110.909 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.493 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.9 OUTLIER -98.54 113.89 26.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 74.219999999999999 111.108 -179.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.492 HD23 ' H ' ' A' ' 485' ' ' LEU . 2.0 pt? -133.15 147.02 52.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 72.400000000000006 110.943 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.92 147.12 23.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 74.310000000000002 110.855 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . 0.679 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -156.73 165.81 35.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 75.540000000000006 111.069 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -53.64 153.52 7.83 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.65 0.738 . . . . 61.130000000000003 110.9 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.7 -12.32 32.77 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.692 2.261 . . . . 74.430000000000007 112.326 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -74.24 -38.34 63.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 71.219999999999999 110.886 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 93.6 t -65.85 124.47 20.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 71.430000000000007 111.114 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -114.97 174.65 5.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 73.219999999999999 110.894 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.447 HG13 ' HB ' ' A' ' 512' ' ' ILE . 96.2 t -52.05 -45.77 41.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.173 -0.467 . . . . 65.329999999999998 111.151 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -54.42 -40.22 68.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 61.439999999999998 110.909 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 85.5 m -67.04 -44.17 80.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 73.120000000000005 111.179 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.547 ' CB ' HD13 ' A' ' 512' ' ' ILE . 5.1 mt -62.22 -51.04 69.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.435 . . . . 74.530000000000001 110.911 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . 0.447 ' HB3' HD12 ' A' ' 512' ' ' ILE . 26.5 ptt180 -64.35 -35.95 82.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 75.340000000000003 110.869 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -63.92 -46.05 86.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 74.230000000000004 110.894 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -69.99 -36.11 74.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 75.219999999999999 110.925 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.603 HD12 HD11 ' A' ' 512' ' ' ILE . 35.7 mt -62.66 -52.78 61.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 72.040000000000006 110.912 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -68.62 -38.04 80.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 75.329999999999998 110.925 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -58.7 -48.02 82.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 72.150000000000006 110.878 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -67.38 -24.33 65.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 75.129999999999995 110.908 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.01 -18.86 18.6 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.738 -0.744 . . . . 70.150000000000006 112.513 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.671 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.1 m-85 -62.57 160.3 35.77 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.673 0.749 . . . . 71.430000000000007 110.896 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 93.18 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.747 2.298 . . . . 72.239999999999995 112.348 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -106.96 -41.03 1.74 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.733 -0.746 . . . . 73.519999999999996 112.513 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -58.75 -51.67 68.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.755 0.312 . . . . 75.540000000000006 110.94 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -31.19 67.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.439 . . . . 70.430000000000007 110.932 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.635 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -63.64 169.91 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 54.140000000000001 111.065 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.96 111.27 25.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 72.239999999999995 111.151 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.603 HD11 HD12 ' A' ' 500' ' ' LEU . 73.4 mt -96.87 136.35 27.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.2 -0.455 . . . . 72.019999999999996 111.131 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.6 m -137.44 140.58 41.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 73.340000000000003 111.109 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -91.98 143.0 26.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.443 . . . . 72.430000000000007 110.885 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 99.0 t -133.74 125.65 49.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 64.420000000000002 111.143 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.97 126.29 30.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 54.240000000000002 110.951 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.586 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -109.53 160.2 28.69 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.564 0.697 . . . . 71.310000000000002 111.112 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.586 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.6 Cg_endo -69.81 74.6 1.3 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.637 2.224 . . . . 72.450000000000003 112.35 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.504 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.9 t -179.91 137.11 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 54.109999999999999 111.123 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.6 24.49 5.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 74.400000000000006 111.114 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.03 -35.31 3.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 44.310000000000002 111.106 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.504 ' O ' HG23 ' A' ' 519' ' ' THR . 7.7 m-85 -135.38 167.22 21.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 63.25 110.914 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 7.8 mmm-85 -137.26 162.2 34.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 71.409999999999997 110.886 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -95.47 144.84 25.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 74.019999999999996 110.909 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.679 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 92.6 m-85 -131.52 122.29 25.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.450000000000003 110.898 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.493 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.4 OUTLIER -103.11 103.57 13.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 73.030000000000001 110.899 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.533 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.5 t -96.59 128.36 47.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 74.510000000000005 111.142 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.538 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 38.4 tttm -104.65 108.55 20.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 64.439999999999998 110.873 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.635 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.9 mt -130.92 154.36 81.95 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.624 0.726 . . . . 61.539999999999999 110.924 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 162.09 43.41 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.697 2.265 . . . . 73.329999999999998 112.338 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.73 105.21 1.44 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.67 2.247 . . . . 75.519999999999996 112.321 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -105.04 -171.1 1.86 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 63.049999999999997 110.943 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 43.2 t -73.53 151.04 41.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 73.239999999999995 110.847 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -52.0 -50.02 62.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 64.340000000000003 110.912 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.3 -49.26 77.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.166 -0.47 . . . . 70.0 110.893 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 14.9 mmp_? -56.45 -56.78 16.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.162 -0.472 . . . . 61.530000000000001 110.902 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 26.1 mtp180 -53.35 -46.51 69.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 72.329999999999998 110.863 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.1 mt -61.44 -37.67 84.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.446 . . . . 72.430000000000007 110.945 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -66.3 -44.28 83.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.172 -0.467 . . . . 74.209999999999994 110.897 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.671 HD22 ' CD2' ' A' ' 505' ' ' PHE . 21.5 tp -63.04 -51.16 67.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 75.340000000000003 110.96 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -58.47 -49.55 76.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.457 . . . . 70.129999999999995 110.873 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 60.8 mtt-85 -58.48 -53.03 62.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 73.329999999999998 110.876 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . 0.462 HD23 ' O ' ' A' ' 543' ' ' LEU . 5.0 tt -52.71 -44.8 66.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 74.329999999999998 110.917 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -59.67 -56.39 22.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 63.149999999999999 110.871 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.3 -13.29 60.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 31.120000000000001 111.092 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 16.8 t -79.51 -57.26 3.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 74.420000000000002 110.849 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -88.37 -52.16 5.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 73.439999999999998 110.89 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.447 HD23 ' HB2' ' A' ' 550' ' ' ALA . 1.3 tp -67.83 -12.47 60.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 75.420000000000002 110.927 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 32.9 mmtm 57.62 23.11 8.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 75.540000000000006 110.87 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . 0.447 ' HB2' HD23 ' A' ' 548' ' ' LEU . . . -66.18 -179.66 0.8 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 34.539999999999999 111.09 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 27.8 m -141.71 110.94 6.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 72.120000000000005 111.191 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.12 107.61 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 74.349999999999994 111.137 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 11.7 mt -83.28 -49.92 8.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 75.319999999999993 110.942 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.46 174.92 11.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 72.340000000000003 111.057 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 82.7 p -156.98 154.91 30.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 74.540000000000006 110.848 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 . . . . . 0 C--N 1.33 -0.247 0 CA-C-N 116.11 -0.496 . . . . 55.409999999999997 110.895 -179.917 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.248 0 N-CA-C 112.455 -0.258 . . . . 73.230000000000004 112.455 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 16.0 m -126.77 109.01 11.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.811 0.339 . . . . 75.420000000000002 111.153 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.688 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -95.53 130.14 42.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 72.329999999999998 111.08 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -119.34 113.6 21.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.203 -0.453 . . . . 65.439999999999998 110.953 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.464 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.9 OUTLIER -96.78 110.98 23.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 64.299999999999997 111.126 -179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.489 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -132.51 143.51 49.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 72.109999999999999 110.957 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -91.05 142.82 27.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 73.420000000000002 110.878 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . 0.519 ' HB3' ' CE1' ' A' ' 525' ' ' PHE . . . -144.58 170.9 15.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 71.239999999999995 111.103 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.28 160.54 40.06 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.607 0.718 . . . . 73.140000000000001 110.908 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 -14.53 36.25 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.683 2.255 . . . . 72.319999999999993 112.334 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -73.22 -44.99 58.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 61.310000000000002 110.849 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.541 HG11 HD21 ' A' ' 548' ' ' LEU . 98.5 t -64.06 138.45 23.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 71.510000000000005 111.13 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -136.27 178.98 6.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 71.430000000000007 110.882 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.463 HG13 ' HB ' ' A' ' 512' ' ' ILE . 48.5 t -51.74 -48.63 37.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 60.539999999999999 111.121 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 60.7 tt0 -51.7 -39.91 59.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 65.120000000000005 110.852 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.0 m -71.55 -35.42 70.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 72.510000000000005 111.195 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.598 ' CB ' HD13 ' A' ' 512' ' ' ILE . 4.9 mt -67.38 -44.71 78.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 73.25 110.888 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -69.97 -46.03 66.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 71.310000000000002 110.876 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.8 ptm180 -64.61 -32.7 74.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 53.329999999999998 110.895 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -73.8 -45.11 53.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 71.099999999999994 110.867 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.412 HD23 HD11 ' A' ' 540' ' ' LEU . 50.3 mt -62.58 -42.45 99.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 74.230000000000004 110.92 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.17 -37.79 66.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 73.349999999999994 110.896 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -61.45 -47.47 85.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 73.5 110.882 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -69.14 -24.29 64.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.164 -0.471 . . . . 73.109999999999999 110.913 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.05 -16.75 20.24 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.77 -0.729 . . . . 54.43 112.453 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.411 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.6 m-85 -68.07 160.25 75.58 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.646 0.736 . . . . 72.230000000000004 110.834 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 97.25 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.649 2.233 . . . . 61.439999999999998 112.363 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -109.83 -44.9 1.0 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.734 -0.746 . . . . 74.430000000000007 112.513 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -60.2 -52.0 67.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.757 0.313 . . . . 74.150000000000006 110.946 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -66.71 -33.4 75.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 74.549999999999997 110.907 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.622 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -63.78 175.4 1.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 71.010000000000005 111.096 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -127.04 116.35 44.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 74.209999999999994 111.137 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.598 HD13 ' CB ' ' A' ' 496' ' ' LEU . 64.1 mt -96.2 143.0 12.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 73.340000000000003 111.114 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.94 135.55 32.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.472 . . . . 73.340000000000003 111.167 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -94.89 143.98 26.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 72.310000000000002 110.888 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 82.7 t -138.62 106.16 3.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 61.530000000000001 111.17 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -72.79 101.38 3.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 65.120000000000005 110.907 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.564 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -79.96 160.23 69.22 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.589 0.709 . . . . 33.32 111.105 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.564 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.3 Cg_endo -69.71 74.54 1.26 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.703 2.269 . . . . 74.230000000000004 112.377 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.602 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.9 t -176.38 139.56 0.35 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 71.219999999999999 111.162 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -97.35 26.01 5.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 72.310000000000002 111.144 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.63 -35.06 3.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 74.420000000000002 111.143 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.602 ' O ' HG23 ' A' ' 519' ' ' THR . 16.6 m-85 -144.12 165.22 28.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.474 . . . . 74.030000000000001 110.915 -179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 26.7 mtt-85 -134.57 156.98 47.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.085 -0.507 . . . . 73.409999999999997 110.844 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -89.47 135.54 33.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.885 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.519 ' CE1' ' HB3' ' A' ' 487' ' ' ALA . 85.2 m-85 -123.62 123.54 40.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 62.219999999999999 110.892 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.464 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -103.61 107.95 19.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.171 -0.468 . . . . 65.120000000000005 110.928 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.554 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.4 t -100.57 121.59 51.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.449 . . . . 52.039999999999999 111.098 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.607 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 12.8 tttm -99.86 109.27 21.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 64.540000000000006 110.933 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.622 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.9 mt -131.24 154.26 81.91 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.596 0.712 . . . . 75.530000000000001 110.95 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 162.14 43.22 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.731 2.287 . . . . 72.310000000000002 112.329 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.86 109.62 2.38 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.622 2.215 . . . . 64.420000000000002 112.32 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.5 mt -111.32 -171.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 71.010000000000005 110.941 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 7.3 t -71.02 171.09 11.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 54.020000000000003 110.86 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -66.91 -48.18 69.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 74.030000000000001 110.873 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -59.07 -34.65 72.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 72.549999999999997 110.879 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 23.7 mmt180 -66.32 -55.76 14.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.455 . . . . 75.209999999999994 110.889 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -56.32 -43.27 78.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 75.140000000000001 110.868 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.3 mt -67.66 -39.35 84.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 75.519999999999996 110.938 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -66.31 -48.29 70.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 72.530000000000001 110.878 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.412 HD11 HD23 ' A' ' 500' ' ' LEU . 21.4 tp -62.02 -51.11 69.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 65.409999999999997 110.943 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -58.37 -51.22 70.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 72.200000000000003 110.883 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -57.96 -52.64 64.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 74.120000000000005 110.874 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 11.0 mt -52.85 -43.64 66.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 75.409999999999997 110.87 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -60.63 -56.52 20.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.438 . . . . 74.510000000000005 110.89 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.32 -13.29 60.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 70.319999999999993 111.09 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.61 -57.51 3.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.436 . . . . 74.340000000000003 110.812 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -88.38 -52.22 5.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 74.019999999999996 110.883 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.541 HD21 HG11 ' A' ' 491' ' ' VAL . 2.0 tp -67.84 -12.42 60.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 64.099999999999994 110.883 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.13 23.47 8.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 72.140000000000001 110.919 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.51 178.5 1.59 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 64.510000000000005 111.07 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 24.4 m -145.08 110.99 5.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 73.040000000000006 111.124 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 61.0 t -54.22 124.8 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 54.32 111.113 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 41.2 mt -108.2 -47.32 3.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 73.409999999999997 110.921 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -151.94 174.06 14.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 51.329999999999998 111.105 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 91.2 p -172.23 148.75 2.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.259 -0.428 . . . . 44.310000000000002 110.852 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.688 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 22.1 pt-20 . . . . . 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.485 . . . . 74.140000000000001 110.855 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.493 -0.243 . . . . 74.239999999999995 112.493 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 29.8 m -131.36 112.95 13.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.351 . . . . 73.209999999999994 111.135 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.775 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -95.02 127.68 41.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 52.039999999999999 111.121 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -116.4 109.84 17.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.451 . . . . 72.340000000000003 110.907 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.585 HG23 HD23 ' A' ' 526' ' ' LEU . 0.5 OUTLIER -94.05 114.63 26.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 65.109999999999999 111.119 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.454 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -137.33 143.56 42.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 61.219999999999999 110.927 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.753 ' HB2' HD11 ' A' ' 553' ' ' LEU . 19.6 ttm180 -95.86 143.15 27.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 72.219999999999999 110.865 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -145.77 171.03 15.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 74.420000000000002 111.1 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -61.28 160.66 21.95 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.673 0.749 . . . . 74.530000000000001 110.87 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -15.36 37.0 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.66 2.24 . . . . 71.109999999999999 112.357 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -69.73 -46.72 65.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 71.310000000000002 110.881 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 41.0 t -68.81 127.79 31.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 72.450000000000003 111.177 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -123.05 178.77 4.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.449 . . . . 74.150000000000006 110.931 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 59.1 t -51.65 -47.77 37.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 74.0 111.133 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -51.77 -40.18 59.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 54.210000000000001 110.923 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.1 m -71.12 -35.36 71.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 74.340000000000003 111.14 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.579 ' CB ' HD13 ' A' ' 512' ' ' ILE . 3.6 mt -67.3 -45.65 75.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 75.409999999999997 110.924 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -68.87 -46.13 69.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 74.430000000000007 110.865 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -64.86 -32.28 73.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 72.040000000000006 110.822 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -73.42 -44.6 57.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 73.239999999999995 110.92 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.74 -41.99 97.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.137 -0.483 . . . . 75.239999999999995 110.96 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -73.09 -37.71 66.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 73.129999999999995 110.949 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.32 -48.2 80.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.104 -0.498 . . . . 74.219999999999999 110.842 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -67.78 -24.44 65.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 73.010000000000005 110.858 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -15.93 20.75 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.756 -0.735 . . . . 64.540000000000006 112.505 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.505 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.6 m-85 -64.7 160.27 54.88 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.681 0.753 . . . . 72.019999999999996 110.853 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 91.09 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.698 2.266 . . . . 72.340000000000003 112.359 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -106.93 -28.16 5.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.717 -0.754 . . . . 61.039999999999999 112.518 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -64.38 -51.85 61.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.778 0.323 . . . . 73.540000000000006 110.92 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -75.66 -34.38 60.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 70.310000000000002 110.883 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.559 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -52.85 165.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 61.229999999999997 111.1 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.04 110.95 24.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 72.140000000000001 111.112 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.579 HD13 ' CB ' ' A' ' 496' ' ' LEU . 61.1 mt -90.66 142.99 12.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 72.319999999999993 111.158 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.59 133.26 47.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 63.229999999999997 111.147 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . 0.409 HE21 ' N ' ' A' ' 515' ' ' VAL . 26.6 tp60 -97.35 118.54 34.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.140000000000001 110.936 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . 0.409 ' N ' HE21 ' A' ' 514' ' ' GLN . 98.1 t -123.32 97.69 4.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.251 -0.431 . . . . 43.310000000000002 111.184 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -74.87 99.06 3.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.430000000000007 110.908 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.592 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -66.98 160.32 70.83 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.567 0.699 . . . . 65.329999999999998 111.133 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.592 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.78 74.41 1.3 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.707 2.271 . . . . 62.340000000000003 112.354 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.9 t 179.1 140.21 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.231 -0.44 . . . . 74.239999999999995 111.097 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.41 33.24 1.62 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 71.109999999999999 111.111 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.63 -33.94 3.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 72.150000000000006 111.122 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -147.74 176.97 9.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 65.329999999999998 110.918 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -148.06 149.12 31.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 63.039999999999999 110.891 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -91.9 138.84 31.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 72.540000000000006 110.938 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -130.64 133.77 46.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 72.439999999999998 110.936 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.585 HD23 HG23 ' A' ' 484' ' ' THR . 0.6 OUTLIER -109.44 106.08 15.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 73.230000000000004 110.889 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.652 HG12 HD21 ' A' ' 529' ' ' LEU . 21.2 t -96.02 112.27 27.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 60.5 111.139 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.502 ' O ' HD23 ' A' ' 529' ' ' LEU . 35.3 tttp -90.47 112.11 23.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 73.310000000000002 110.913 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.652 HD21 HG12 ' A' ' 527' ' ' VAL . 6.5 mt -132.67 154.28 81.42 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.592 0.711 . . . . 72.109999999999999 110.895 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 162.2 42.99 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.67 2.247 . . . . 71.120000000000005 112.342 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 107.46 1.86 Allowed 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.665 2.244 . . . . 73.409999999999997 112.361 179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -109.12 -170.99 1.76 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.195 -0.457 . . . . 71.349999999999994 110.958 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 7.8 p -72.74 152.05 41.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 74.519999999999996 110.89 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -51.94 -41.18 61.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.154 -0.475 . . . . 70.129999999999995 110.864 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -62.09 -43.93 97.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 62.149999999999999 110.858 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? -64.64 -48.48 74.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 74.319999999999993 110.903 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -56.41 -52.98 62.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 73.230000000000004 110.858 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -64.34 -40.51 96.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 74.340000000000003 110.925 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.46 -46.17 91.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 55.149999999999999 110.848 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.505 HD22 ' CD2' ' A' ' 505' ' ' PHE . 24.0 tp -64.01 -51.06 65.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 44.119999999999997 110.863 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -57.78 -50.12 74.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 72.540000000000006 110.871 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -57.94 -53.44 58.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 63.350000000000001 110.899 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 543' ' ' LEU . 3.0 tt -52.63 -43.37 65.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 64.450000000000003 110.922 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -60.63 -56.53 20.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.209999999999994 110.894 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.43 -13.3 60.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 52.109999999999999 111.063 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.59 -57.3 3.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 73.030000000000001 110.882 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -88.36 -52.24 5.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.14 -0.482 . . . . 73.409999999999997 110.914 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.86 -12.42 60.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.540000000000006 110.933 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt 57.45 23.27 8.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.168 -0.469 . . . . 74.340000000000003 110.901 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.26 -179.05 0.92 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 73.430000000000007 111.075 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 89.8 m -145.01 110.95 5.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 70.129999999999995 111.171 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 31.7 t -55.62 108.53 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 72.299999999999997 111.149 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . 0.753 HD11 ' HB2' ' A' ' 486' ' ' ARG . 27.2 mt -85.43 -43.19 13.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 73.519999999999996 110.925 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -166.54 174.54 8.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 64.310000000000002 111.059 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 75.7 m -161.38 148.93 15.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.454 . . . . 73.230000000000004 110.845 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.775 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 24.9 pt-20 . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 71.400000000000006 110.874 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.367 0 N-CA-C 112.507 -0.237 . . . . 73.040000000000006 112.507 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 61.3 m -125.13 114.15 18.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 71.409999999999997 111.129 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.769 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -98.87 138.71 35.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 71.409999999999997 111.085 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -123.89 112.13 16.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 74.430000000000007 110.916 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.8 m -93.89 110.14 21.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 73.140000000000001 111.112 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.481 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.7 pt? -132.57 145.35 51.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 73.200000000000003 110.938 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 23.5 ttp180 -100.0 129.01 46.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 75.420000000000002 110.866 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -131.83 170.97 14.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 63.210000000000001 111.083 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -58.19 160.26 9.49 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.643 0.735 . . . . 62.329999999999998 110.86 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -15.66 37.17 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.724 2.282 . . . . 74.010000000000005 112.324 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -71.7 -45.56 61.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 64.099999999999994 110.93 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.532 HG11 HD21 ' A' ' 548' ' ' LEU . 99.2 t -61.42 121.11 8.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 63.329999999999998 111.123 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -117.07 173.79 6.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 73.319999999999993 110.913 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.5 t -51.56 -48.5 35.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 51.439999999999998 111.111 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -52.44 -39.81 61.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 52.340000000000003 110.896 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.3 m -71.2 -35.58 71.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 65.349999999999994 111.151 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.759 ' HB3' HD13 ' A' ' 512' ' ' ILE . 2.8 mt -67.36 -45.58 75.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 74.239999999999995 110.908 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.6 ptt85 -69.0 -46.05 69.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 72.340000000000003 110.892 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -64.86 -32.12 73.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 74.409999999999997 110.82 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -73.36 -45.64 53.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.222 -0.445 . . . . 74.340000000000003 110.861 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 49.2 mt -62.86 -42.1 99.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 73.140000000000001 110.891 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -73.06 -37.65 66.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.431 . . . . 73.209999999999994 110.902 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -61.38 -48.92 79.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 72.450000000000003 110.955 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -67.51 -22.78 65.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.491 . . . . 61.049999999999997 110.907 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -18.43 18.95 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.739 -0.743 . . . . 74.109999999999999 112.474 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.493 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.4 m-85 -66.08 160.3 64.74 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.664 0.745 . . . . 74.120000000000005 110.876 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 101.93 0.97 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.71 2.273 . . . . 70.549999999999997 112.319 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -120.72 -30.55 1.36 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.731 -0.747 . . . . 75.329999999999998 112.472 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.2 -42.28 65.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.707 0.289 . . . . 71.310000000000002 110.882 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -80.46 -36.83 32.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 73.409999999999997 110.898 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.627 ' HB1' ' O ' ' A' ' 528' ' ' LYS . . . -59.21 177.46 0.17 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.159 -0.473 . . . . 72.239999999999995 111.068 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.0 112.52 29.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 73.519999999999996 111.123 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.759 HD13 ' HB3' ' A' ' 496' ' ' LEU . 47.3 mt -96.16 128.06 47.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 54.210000000000001 111.12 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.98 147.21 46.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 61.450000000000003 111.122 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.5 tm0? -103.61 144.02 31.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 74.310000000000002 110.927 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 94.5 t -136.57 108.73 7.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 71.319999999999993 111.127 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.01 109.72 15.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 74.150000000000006 110.951 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.589 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -89.44 160.32 42.39 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.561 0.696 . . . . 71.099999999999994 111.139 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.589 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.8 Cg_endo -69.75 74.44 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.696 2.264 . . . . 73.239999999999995 112.35 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t 179.27 136.54 0.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 75.200000000000003 111.127 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -96.46 32.32 2.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 43.210000000000001 111.07 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.97 -34.16 3.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 44.549999999999997 111.092 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -150.81 145.67 25.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.208 -0.451 . . . . 74.340000000000003 110.944 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -115.98 154.39 29.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.117 -0.492 . . . . 74.430000000000007 110.87 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . 0.549 ' HG2' HD12 ' A' ' 553' ' ' LEU . 7.2 mt-10 -92.18 149.23 21.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 72.129999999999995 110.893 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -138.96 133.51 31.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 73.409999999999997 110.907 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.769 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.4 OUTLIER -109.15 106.8 16.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.131 -0.486 . . . . 52.439999999999998 110.937 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.596 HG12 HD21 ' A' ' 529' ' ' LEU . 19.9 t -95.97 113.27 29.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 63.25 111.159 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.627 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 2.9 tptm -92.46 108.57 20.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.239999999999995 110.901 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.621 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -132.45 154.55 81.6 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.608 0.718 . . . . 73.400000000000006 110.907 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 162.29 42.62 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.719 2.28 . . . . 63.520000000000003 112.382 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 103.98 1.25 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.7 2.267 . . . . 72.049999999999997 112.334 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.4 mt -103.62 -171.05 1.87 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 73.430000000000007 110.917 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 28.4 t -70.22 149.06 47.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 62.100000000000001 110.815 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -51.71 -48.45 63.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 75.420000000000002 110.848 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.1 -44.82 96.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 72.430000000000007 110.927 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 21.7 mmt85 -59.07 -55.85 29.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 73.150000000000006 110.843 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 67.4 mtp180 -53.83 -53.0 58.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 73.310000000000002 110.881 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.1 mt -56.41 -37.01 69.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 75.030000000000001 110.903 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.0 -46.0 83.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 73.310000000000002 110.864 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.493 HD22 ' CD2' ' A' ' 505' ' ' PHE . 22.1 tp -61.44 -50.86 71.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 61.210000000000001 110.906 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -57.3 -50.91 71.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 75.030000000000001 110.902 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -58.04 -52.71 64.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.486 . . . . 62.229999999999997 110.85 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.4 tt -52.6 -44.19 65.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 61.32 110.913 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -60.43 -56.29 23.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 73.209999999999994 110.928 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.01 -13.43 59.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 71.439999999999998 111.142 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.9 t -79.66 -57.72 3.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 64.439999999999998 110.887 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -88.29 -52.18 5.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.118 -0.492 . . . . 73.299999999999997 110.91 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.532 HD21 HG11 ' A' ' 491' ' ' VAL . 0.8 OUTLIER -67.82 -12.43 60.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 74.409999999999997 110.944 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 26.8 mmtp 56.74 24.0 8.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 74.409999999999997 110.867 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.77 177.72 1.98 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 73.430000000000007 111.076 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 40.8 m -140.28 110.87 6.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 71.040000000000006 111.136 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.51 102.03 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 64.439999999999998 111.137 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . 0.549 HD12 ' HG2' ' A' ' 524' ' ' GLU . 28.6 mt -77.85 -43.25 30.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 75.400000000000006 110.917 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -168.55 176.44 5.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 53.219999999999999 111.109 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 99.2 p -160.18 153.94 22.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 60.109999999999999 110.864 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.753 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 8.2 pm0 . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 74.230000000000004 110.895 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.465 -0.254 . . . . 54.530000000000001 112.465 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . 0.464 HG23 ' O ' ' A' ' 556' ' ' GLU . 25.7 m -128.52 113.4 15.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.825 0.345 . . . . 74.0 111.116 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.795 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -94.91 142.64 27.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 64.310000000000002 111.123 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -132.11 110.67 10.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.244 -0.435 . . . . 74.420000000000002 110.921 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.638 HG22 ' OE2' ' A' ' 524' ' ' GLU . 0.2 OUTLIER -96.73 114.78 26.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 63.240000000000002 111.123 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.442 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.7 pt? -135.76 142.56 44.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 62.340000000000003 110.962 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -88.3 146.94 25.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 63.530000000000001 110.865 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -152.54 169.73 21.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 44.439999999999998 111.131 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -70.49 160.66 80.61 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.669 0.747 . . . . 70.230000000000004 110.861 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -10.95 29.76 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.669 2.246 . . . . 74.319999999999993 112.301 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -71.29 -31.15 67.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 73.219999999999999 110.872 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 23.7 t -86.83 134.77 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.139 -0.482 . . . . 75.310000000000002 111.134 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -127.06 177.56 6.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.445 . . . . 74.439999999999998 110.9 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 81.8 t -51.96 -50.01 35.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 54.039999999999999 111.131 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -53.72 -40.07 65.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 73.549999999999997 110.923 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 63.7 m -67.52 -42.8 82.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 72.430000000000007 111.162 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.542 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.6 mt -61.21 -51.06 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 63.109999999999999 110.933 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . 0.401 ' HB3' HD12 ' A' ' 512' ' ' ILE . 9.4 ptm180 -64.1 -40.12 95.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 72.120000000000005 110.85 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -60.46 -44.12 96.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 65.439999999999998 110.835 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -70.81 -39.55 73.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.441 . . . . 72.310000000000002 110.877 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.545 HD12 HD11 ' A' ' 512' ' ' ILE . 36.0 mt -58.87 -49.9 76.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 73.340000000000003 110.917 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -72.13 -37.98 69.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 74.310000000000002 110.886 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -56.06 -48.75 75.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 61.100000000000001 110.914 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.537 ' HE2' HD13 ' A' ' 543' ' ' LEU . 13.7 mmmt -69.71 -23.7 63.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.473 . . . . 73.209999999999994 110.948 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.0 -17.68 19.64 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.758 -0.734 . . . . 62.219999999999999 112.495 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -63.4 160.26 43.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.628 0.728 . . . . 62.140000000000001 110.881 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 93.39 0.52 Allowed 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.673 2.249 . . . . 43.229999999999997 112.348 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.16 -28.23 3.41 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.705 -0.76 . . . . 52.310000000000002 112.468 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -70.43 -51.74 27.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.718 0.294 . . . . 74.439999999999998 110.888 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.38 -34.34 67.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 75.030000000000001 110.932 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.652 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -61.46 172.32 1.2 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 62.32 111.107 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.97 116.47 44.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 55.530000000000001 111.101 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.545 HD11 HD12 ' A' ' 500' ' ' LEU . 65.5 mt -98.36 123.2 50.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 73.430000000000007 111.158 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.7 m -113.91 143.15 45.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 62.030000000000001 111.12 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -98.16 128.91 44.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 73.400000000000006 110.923 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.72 92.27 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 72.420000000000002 111.16 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.7 114.85 5.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 61.439999999999998 110.929 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.606 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -88.64 161.17 42.79 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.56 0.695 . . . . 64.129999999999995 111.128 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.606 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.76 72.17 1.47 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.762 2.308 . . . . 73.310000000000002 112.325 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.4 t 177.23 141.9 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 74.120000000000005 111.15 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.87 31.35 2.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 52.32 111.138 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -126.06 -35.67 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 71.129999999999995 111.06 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.582 ' O ' HG23 ' A' ' 519' ' ' THR . 18.0 m-85 -150.1 150.55 31.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.226 -0.443 . . . . 63.420000000000002 110.898 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.18 161.76 34.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 70.319999999999993 110.859 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . 0.667 ' OE1' HD12 ' A' ' 553' ' ' LEU . 41.1 tp10 -94.71 152.38 18.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 64.510000000000005 110.869 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -136.31 126.94 27.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 72.230000000000004 110.868 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.795 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -98.61 107.46 19.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 72.430000000000007 110.896 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.554 HG12 HD21 ' A' ' 529' ' ' LEU . 21.4 t -95.88 112.02 27.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 75.409999999999997 111.114 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.61 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 0.8 OUTLIER -91.55 108.44 19.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.16 -0.473 . . . . 71.319999999999993 110.903 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.652 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.3 mt -131.86 154.47 81.77 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.605 0.717 . . . . 74.230000000000004 110.893 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 162.22 42.94 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.675 2.25 . . . . 63.439999999999998 112.352 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 106.45 1.67 Allowed 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.733 2.289 . . . . 70.420000000000002 112.317 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -108.83 -171.02 1.77 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 74.340000000000003 110.941 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 53.7 m -71.79 153.83 41.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 74.549999999999997 110.848 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -52.27 -47.44 65.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.128 -0.487 . . . . 60.310000000000002 110.844 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -58.95 -37.77 77.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.926 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.4 mmp_? -64.22 -58.04 7.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 71.219999999999999 110.839 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -53.1 -47.02 68.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 73.209999999999994 110.873 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mt -66.01 -37.04 84.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 63.329999999999998 110.882 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -65.97 -46.66 77.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 73.120000000000005 110.831 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -63.99 -51.18 65.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 73.230000000000004 110.921 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -58.14 -50.45 73.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 71.540000000000006 110.854 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -58.05 -53.41 58.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 72.019999999999996 110.878 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . 0.537 HD13 ' HE2' ' A' ' 503' ' ' LYS . 7.9 mt -52.63 -43.59 65.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 71.319999999999993 110.941 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.53 -56.56 19.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 75.409999999999997 110.857 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.26 -13.32 60.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 61.310000000000002 111.1 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 22.8 t -79.6 -57.39 3.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 75.219999999999999 110.845 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -88.4 -52.18 5.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 74.219999999999999 110.879 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -12.36 60.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 71.549999999999997 110.91 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.5 mmmt 57.11 23.58 8.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 71.239999999999995 110.894 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.95 177.86 1.57 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.439999999999998 111.077 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 49.1 m -140.39 111.01 6.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 75.129999999999995 111.12 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 61.8 t -60.47 119.56 4.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 63.109999999999999 111.108 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . 0.667 HD12 ' OE1' ' A' ' 524' ' ' GLU . 17.6 mt -103.09 -48.03 4.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 55.119999999999997 110.89 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -143.61 170.09 16.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 64.099999999999994 111.073 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 54.8 p -175.8 133.99 0.28 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 64.140000000000001 110.851 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.464 ' O ' HG23 ' A' ' 481' ' ' THR . 4.3 pt-20 . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 73.049999999999997 110.877 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 N-CA-C 112.477 -0.249 . . . . 71.200000000000003 112.477 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 97.0 m -129.95 106.89 8.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.783 0.325 . . . . 73.400000000000006 111.126 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.708 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -94.97 136.42 35.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 54.520000000000003 111.121 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -124.2 111.18 15.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.252 -0.431 . . . . 73.099999999999994 110.906 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.504 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.5 OUTLIER -94.92 110.97 22.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 73.200000000000003 111.172 -180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.441 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -135.73 146.38 47.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.246 -0.434 . . . . 63.240000000000002 110.937 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.59 ' HD3' HD11 ' A' ' 553' ' ' LEU . 26.1 mtp180 -97.4 127.22 43.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.16 -0.473 . . . . 73.530000000000001 110.868 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . 0.448 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -123.84 171.06 9.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 61.32 111.134 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -66.29 160.63 63.88 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.667 0.746 . . . . 72.25 110.901 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -16.3 37.63 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.692 2.261 . . . . 73.219999999999999 112.366 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -72.5 -34.02 67.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 64.439999999999998 110.887 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 85.4 t -80.14 124.59 38.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.475 . . . . 71.530000000000001 111.132 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -118.61 178.85 4.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 74.540000000000006 110.878 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 38.7 t -51.62 -48.73 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 75.239999999999995 111.158 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -51.71 -41.12 61.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 65.540000000000006 110.882 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.4 m -71.09 -34.55 71.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 54.299999999999997 111.14 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.778 ' HB3' HD13 ' A' ' 512' ' ' ILE . 2.3 mt -67.48 -44.54 78.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.451 . . . . 72.150000000000006 110.872 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -70.08 -45.55 66.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 65.209999999999994 110.849 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -65.05 -32.62 74.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 72.150000000000006 110.84 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -73.58 -46.3 48.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 74.019999999999996 110.884 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.7 -42.3 98.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 74.450000000000003 110.893 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.24 -37.55 66.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 71.349999999999994 110.907 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -60.58 -49.31 78.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 75.129999999999995 110.897 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -24.02 67.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 72.439999999999998 110.918 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.07 -17.73 19.43 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.794 -0.717 . . . . 75.319999999999993 112.518 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.464 ' CD2' HD22 ' A' ' 540' ' ' LEU . 15.3 m-85 -68.01 160.3 75.05 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.666 0.746 . . . . 60.439999999999998 110.852 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 100.25 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.693 2.262 . . . . 72.209999999999994 112.29 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -119.85 -25.19 2.62 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.757 -0.735 . . . . 55.140000000000001 112.458 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -72.88 -40.18 65.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.735 0.302 . . . . 71.219999999999999 110.914 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -85.23 -34.29 22.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 75.200000000000003 110.873 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.633 ' HB1' ' O ' ' A' ' 528' ' ' LYS . . . -61.43 -177.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.445 . . . . 64.329999999999998 111.087 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 23.4 t -126.98 143.06 41.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 54.32 111.108 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.778 HD13 ' HB3' ' A' ' 496' ' ' LEU . 30.6 mt -125.61 120.4 57.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.174 -0.466 . . . . 52.539999999999999 111.129 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.53 141.6 48.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 74.299999999999997 111.163 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -100.37 141.65 32.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 70.530000000000001 110.91 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 93.2 t -135.0 108.55 10.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 71.530000000000001 111.164 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 12.4 tm0? -71.19 116.74 11.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 74.430000000000007 110.947 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.581 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -96.22 160.23 30.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.575 0.702 . . . . 61.140000000000001 111.129 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.581 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.8 Cg_endo -69.76 74.6 1.28 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.663 2.242 . . . . 60.539999999999999 112.306 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.538 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.3 t 179.99 138.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 73.230000000000004 111.1 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.48 27.18 3.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 64.129999999999995 111.09 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.53 -34.93 3.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 75.120000000000005 111.081 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.538 ' O ' HG23 ' A' ' 519' ' ' THR . 14.1 m-85 -144.98 164.75 30.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 73.420000000000002 110.943 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 48.9 mtm180 -137.33 160.61 38.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 63.310000000000002 110.898 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -93.98 149.31 21.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 72.019999999999996 110.886 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.448 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 83.1 m-85 -142.43 134.57 27.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 72.230000000000004 110.848 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.708 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -108.36 107.72 18.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.095 -0.502 . . . . 64.129999999999995 110.91 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.575 HG12 HD21 ' A' ' 529' ' ' LEU . 21.3 t -96.2 112.46 28.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 72.450000000000003 111.1 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.633 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 34.7 tttt -91.93 108.93 20.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.479 . . . . 73.329999999999998 110.901 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.632 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.3 mt -131.89 154.42 81.74 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.631 0.729 . . . . 52.130000000000003 110.89 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 162.25 42.79 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.627 2.218 . . . . 71.219999999999999 112.341 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 112.42 3.08 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.678 2.252 . . . . 64.109999999999999 112.308 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.79 -170.98 1.77 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 63.140000000000001 110.91 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 40.9 t -68.88 155.51 40.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 35.020000000000003 110.844 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -54.73 -50.31 68.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 54.140000000000001 110.905 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -60.06 -37.16 79.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.458 . . . . 64.310000000000002 110.881 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -64.19 -55.6 20.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 75.400000000000006 110.893 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 53.7 mtm180 -55.81 -53.06 61.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 73.540000000000006 110.844 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.0 mt -59.23 -37.77 78.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 71.120000000000005 110.897 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.93 -50.07 67.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 65.439999999999998 110.877 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.464 HD22 ' CD2' ' A' ' 505' ' ' PHE . 23.0 tp -57.92 -51.08 71.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 60.210000000000001 110.922 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . 0.402 ' OE1' HG22 ' A' ' 552' ' ' VAL . 17.2 mm-40 -57.26 -50.89 71.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.454 . . . . 74.209999999999994 110.869 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -57.88 -51.91 67.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 52.420000000000002 110.878 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.8 -44.65 66.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 71.099999999999994 110.851 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -60.39 -56.35 22.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 110.878 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.87 -13.47 59.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 73.340000000000003 111.102 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.61 -57.96 3.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 75.209999999999994 110.859 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -88.26 -52.2 5.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.489 . . . . 75.349999999999994 110.907 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.76 -12.47 60.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 73.540000000000006 110.871 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt 56.3 24.37 8.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 75.120000000000005 110.905 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.41 174.14 3.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 72.420000000000002 111.091 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 93.3 m -133.72 111.69 10.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 73.409999999999997 111.13 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . 0.402 HG22 ' OE1' ' A' ' 541' ' ' GLU . 42.8 t -59.98 109.04 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 50.409999999999997 111.15 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . 0.59 HD11 ' HD3' ' A' ' 486' ' ' ARG . 11.7 mt -86.84 -45.38 10.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 75.409999999999997 110.922 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.61 172.38 14.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 70.129999999999995 111.144 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 20.6 p -158.26 157.37 32.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 73.239999999999995 110.877 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 75.430000000000007 110.892 -179.951 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.51 -0.236 . . . . 63.299999999999997 112.51 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 25.0 m -127.25 108.65 11.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.835 0.35 . . . . 63.149999999999999 111.147 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.622 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -95.41 129.99 42.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 74.450000000000003 111.151 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -118.24 113.32 21.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.244 -0.434 . . . . 74.420000000000002 110.936 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -94.38 110.33 22.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 71.120000000000005 111.115 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.503 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -130.51 143.6 50.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 75.549999999999997 110.933 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -94.1 126.77 39.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 73.230000000000004 110.894 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -127.02 170.95 11.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 74.420000000000002 111.141 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -61.21 160.42 22.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.666 0.746 . . . . 75.140000000000001 110.881 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -17.76 37.36 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.698 2.265 . . . . 52.119999999999997 112.303 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -73.02 -44.15 61.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 73.0 110.944 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.436 HG21 ' HG ' ' A' ' 548' ' ' LEU . 95.7 t -60.71 125.55 17.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 41.530000000000001 111.143 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -123.48 176.68 6.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 71.420000000000002 110.862 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 90.3 t -51.63 -49.24 35.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.487 . . . . 73.5 111.096 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -51.17 -40.27 58.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 73.519999999999996 110.911 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.3 m -72.96 -35.12 66.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 73.239999999999995 111.154 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.587 ' HB3' HD13 ' A' ' 512' ' ' ILE . 4.8 mt -67.46 -44.1 79.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 54.409999999999997 110.908 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.05 -46.13 62.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 61.539999999999999 110.888 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -63.97 -33.21 75.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 71.420000000000002 110.907 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -73.98 -47.44 37.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.465 . . . . 73.420000000000002 110.835 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 35.8 mt -59.6 -43.35 93.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 71.040000000000006 110.91 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -73.09 -37.76 66.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.169 -0.469 . . . . 71.530000000000001 110.92 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.35 -49.04 78.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 65.25 110.871 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.693 ' NZ ' HD13 ' A' ' 543' ' ' LEU . 0.2 OUTLIER -68.2 -24.76 64.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 74.340000000000003 110.901 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -17.98 19.34 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.754 -0.736 . . . . 73.040000000000006 112.475 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -61.54 160.28 26.81 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.66 0.743 . . . . 71.439999999999998 110.846 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 86.87 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.672 2.248 . . . . 72.319999999999993 112.32 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -108.89 -22.09 7.12 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.745 -0.74 . . . . 74.230000000000004 112.494 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -75.85 -40.79 54.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.727 0.299 . . . . 75.400000000000006 110.839 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -85.28 -29.45 24.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.427 . . . . 74.200000000000003 110.887 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.632 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -62.77 173.8 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.466 . . . . 64.019999999999996 111.078 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.05 117.04 46.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.420000000000002 111.152 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.587 HD13 ' HB3' ' A' ' 496' ' ' LEU . 62.1 mt -96.91 137.33 24.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 75.299999999999997 111.071 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.13 150.35 52.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 72.409999999999997 111.146 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -102.5 144.0 31.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 74.109999999999999 110.913 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.5 t -138.62 108.95 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 71.200000000000003 111.136 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -77.56 107.42 10.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 65.209999999999994 110.929 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.576 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -88.9 160.22 44.13 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.578 0.704 . . . . 72.430000000000007 111.103 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.576 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.1 Cg_endo -69.71 74.54 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.68 2.254 . . . . 72.329999999999998 112.353 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.1 t -176.03 140.05 0.4 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 75.140000000000001 111.136 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -99.95 26.31 6.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 62.450000000000003 111.096 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.69 -34.02 3.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 73.219999999999999 111.1 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.582 ' O ' HG23 ' A' ' 519' ' ' THR . 12.0 m-85 -145.1 157.28 44.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 74.409999999999997 110.925 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.16 157.43 34.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 74.310000000000002 110.873 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . 0.481 ' CD ' ' HB2' ' A' ' 517' ' ' ALA . 12.4 mt-10 -93.73 141.86 28.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 70.120000000000005 110.901 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.448 ' O ' HD23 ' A' ' 485' ' ' LEU . 83.6 m-85 -130.46 128.95 42.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 71.150000000000006 110.846 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.622 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.6 OUTLIER -104.15 105.51 15.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 75.25 110.957 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.534 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.2 t -95.98 116.68 38.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 72.150000000000006 111.148 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.588 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 5.7 tptm -94.74 107.41 19.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 65.409999999999997 110.896 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.632 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.4 mt -130.65 154.29 81.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.56 0.695 . . . . 70.310000000000002 110.939 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 162.14 43.25 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.646 2.231 . . . . 61.210000000000001 112.341 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 108.83 2.17 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.682 2.254 . . . . 63.420000000000002 112.338 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.2 mt -109.41 -171.08 1.77 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 63.509999999999998 110.93 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.84 154.88 40.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 54.530000000000001 110.82 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -51.98 -46.08 64.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.096 -0.502 . . . . 71.209999999999994 110.875 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.85 -36.12 78.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 65.319999999999993 110.877 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -65.04 -54.35 31.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 72.239999999999995 110.888 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 43.0 mtt180 -57.16 -48.11 79.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 64.340000000000003 110.865 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.7 mt -63.8 -43.59 95.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 73.209999999999994 110.888 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -62.92 -44.51 95.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 71.510000000000005 110.892 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.2 tp -62.35 -51.23 68.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.157 -0.474 . . . . 53.049999999999997 110.938 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -56.08 -49.66 73.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 74.310000000000002 110.919 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -57.93 -51.91 67.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 72.230000000000004 110.857 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . 0.693 HD13 ' NZ ' ' A' ' 503' ' ' LYS . 0.5 OUTLIER -52.88 -44.35 66.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 63.119999999999997 110.9 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -60.31 -56.74 17.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 72.030000000000001 110.84 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.18 -13.11 59.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 70.340000000000003 111.122 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.73 -58.31 3.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 60.439999999999998 110.816 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -88.56 -52.17 5.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 75.140000000000001 110.828 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.436 ' HG ' HG21 ' A' ' 491' ' ' VAL . 1.8 tp -67.76 -12.71 61.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 74.400000000000006 110.919 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp 56.65 23.36 7.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.219999999999999 110.904 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -71.2 -179.82 2.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 62.420000000000002 111.125 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 94.2 m -144.99 111.29 5.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 73.140000000000001 111.144 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.4 t -53.23 122.81 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 75.310000000000002 111.158 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . 0.454 HD12 ' HG2' ' A' ' 524' ' ' GLU . 18.2 mt -101.28 -47.55 4.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 70.120000000000005 110.893 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -158.28 175.15 14.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 64.420000000000002 111.092 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 88.5 p -161.33 152.71 18.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.443 . . . . 75.239999999999995 110.867 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 73.430000000000007 110.845 -179.948 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.366 0 N-CA-C 112.481 -0.247 . . . . 74.099999999999994 112.481 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 95.6 m -130.04 112.59 13.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.792 0.33 . . . . 54.530000000000001 111.135 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.529 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -94.95 143.89 26.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 64.430000000000007 111.085 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -131.44 116.41 17.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 74.0 110.916 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.616 HG22 ' CD ' ' A' ' 524' ' ' GLU . 0.2 OUTLIER -98.1 112.48 24.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.124 -0.489 . . . . 55.310000000000002 111.13 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.459 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -134.78 147.8 50.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 35.340000000000003 110.967 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.446 ' NH2' HG21 ' A' ' 519' ' ' THR . 6.8 ttt180 -93.17 136.23 33.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.455 . . . . 65.340000000000003 110.883 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -139.67 161.86 36.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 54.530000000000001 111.105 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . 0.572 ' HG2' HG23 ' A' ' 491' ' ' VAL . 5.2 pm0 -51.98 156.87 2.35 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.685 0.755 . . . . 73.439999999999998 110.879 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -8.82 24.57 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.65 2.234 . . . . 73.219999999999999 112.339 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -82.43 -42.4 18.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 75.349999999999994 110.881 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.572 HG23 ' HG2' ' A' ' 488' ' ' GLU . 97.7 t -64.16 124.09 18.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 51.219999999999999 111.14 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -120.55 177.42 5.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.203 -0.453 . . . . 74.219999999999999 110.865 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.683 HG13 ' HB ' ' A' ' 512' ' ' ILE . 47.7 t -51.46 -47.49 35.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 64.510000000000005 111.113 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -51.83 -41.65 61.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.230000000000004 110.852 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.9 m -70.79 -34.46 71.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 43.140000000000001 111.123 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.555 HD13 ' CG2' ' A' ' 512' ' ' ILE . 2.6 mt -67.2 -45.42 76.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 73.239999999999995 110.9 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 -69.89 -45.42 67.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 72.25 110.83 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -64.93 -31.94 73.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 72.049999999999997 110.9 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . 0.505 ' HZ ' HD22 ' A' ' 543' ' ' LEU . 36.9 t80 -75.17 -43.24 53.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 73.310000000000002 110.868 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 51.0 mt -63.48 -43.96 95.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.465 . . . . 72.439999999999998 110.885 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -71.71 -42.07 67.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 71.209999999999994 110.9 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.89 -49.0 78.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 71.239999999999995 110.868 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -66.24 -23.98 66.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.462 . . . . 72.209999999999994 110.896 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -18.67 18.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.706 -0.759 . . . . 74.540000000000006 112.472 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -67.52 160.25 73.42 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.682 0.753 . . . . 73.25 110.851 -179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 101.7 0.94 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.671 2.247 . . . . 71.319999999999993 112.335 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -123.51 -33.06 0.84 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.719 -0.753 . . . . 41.409999999999997 112.496 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 20.5 pttt -61.52 -43.5 98.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.746 0.308 . . . . 73.129999999999995 110.911 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -83.38 -31.51 26.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 72.200000000000003 110.883 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.587 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -55.79 172.06 0.19 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 42.399999999999999 111.114 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.6 t -126.93 111.09 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 72.140000000000001 111.109 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.683 ' HB ' HG13 ' A' ' 493' ' ' VAL . 34.5 mt -92.28 142.45 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 52.439999999999998 111.147 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.53 134.83 36.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 74.349999999999994 111.157 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -91.52 142.76 27.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 62.520000000000003 110.883 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 61.7 t -138.15 108.27 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 70.040000000000006 111.168 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -74.9 132.68 41.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 73.109999999999999 110.919 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.577 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -116.1 160.3 36.11 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.593 0.711 . . . . 42.420000000000002 111.099 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.577 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.79 74.45 1.3 Allowed 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.65 2.234 . . . . 64.209999999999994 112.358 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.446 HG21 ' NH2' ' A' ' 486' ' ' ARG . 3.0 t -179.83 141.77 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.254 -0.43 . . . . 64.140000000000001 111.16 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -101.04 29.02 4.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 73.450000000000003 111.142 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.6 -34.66 3.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 71.230000000000004 111.084 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -146.38 166.09 27.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.442 . . . . 71.400000000000006 110.929 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 19.8 mtm-85 -136.83 160.92 37.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 72.409999999999997 110.873 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . 0.616 ' CD ' HG22 ' A' ' 484' ' ' THR . 6.8 tp10 -93.94 140.21 29.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 70.349999999999994 110.903 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -130.8 132.42 45.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.115 -0.493 . . . . 73.439999999999998 110.907 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.614 HD23 HG23 ' A' ' 484' ' ' THR . 0.6 OUTLIER -112.99 107.05 15.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 73.230000000000004 110.904 -179.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.533 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.1 t -97.35 133.5 38.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 63.140000000000001 111.098 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.511 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 43.6 tttt -108.65 107.94 18.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 73.239999999999995 110.93 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.587 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -129.7 154.61 80.98 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.628 0.728 . . . . 75.120000000000005 110.89 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.28 42.67 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.716 2.278 . . . . 50.5 112.306 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 110.95 2.67 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.679 2.252 . . . . 64.030000000000001 112.361 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.6 mt -114.28 -170.99 1.83 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.429 . . . . 72.299999999999997 110.915 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.1 p -74.55 154.03 38.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 62.43 110.862 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -51.92 -40.62 61.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 70.319999999999993 110.839 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -61.25 -42.88 99.38 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.455 . . . . 73.420000000000002 110.926 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -63.34 -52.58 61.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 61.130000000000003 110.903 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -54.5 -52.95 60.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 62.32 110.845 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.36 -36.18 82.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 54.549999999999997 110.913 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -64.54 -49.84 69.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 72.010000000000005 110.903 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -62.53 -51.0 69.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 75.439999999999998 110.975 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -56.37 -47.71 78.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 70.530000000000001 110.891 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -59.87 -53.89 52.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 73.209999999999994 110.848 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . 0.505 HD22 ' HZ ' ' A' ' 499' ' ' PHE . 0.8 OUTLIER -52.66 -44.08 65.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 53.119999999999997 110.898 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.26 -56.46 21.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.439999999999998 110.887 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.14 -13.37 60.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 75.400000000000006 111.16 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 20.0 t -79.57 -57.54 3.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 71.420000000000002 110.829 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -88.38 -52.26 5.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 75.140000000000001 110.899 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.498 HD21 HG11 ' A' ' 491' ' ' VAL . 1.2 tp -67.76 -12.46 60.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.111 -0.495 . . . . 62.039999999999999 110.952 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 23.1 mmtp 57.16 23.46 8.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 65.519999999999996 110.893 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.32 178.39 1.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.454 . . . . 63.32 111.094 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 90.8 m -145.01 110.91 5.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 74.129999999999995 111.154 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 36.4 t -54.73 131.88 17.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 63.509999999999998 111.117 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 46.5 mt -115.18 -43.6 3.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 72.109999999999999 110.888 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -157.44 174.85 14.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 64.239999999999995 111.087 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 5.2 p -169.27 148.63 3.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 71.540000000000006 110.813 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.113 -0.494 . . . . 65.219999999999999 110.927 179.988 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.544 -0.222 . . . . 40.350000000000001 112.544 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 33.2 m -125.19 108.35 11.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.788 0.328 . . . . 73.310000000000002 111.116 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.518 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -96.75 125.22 41.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 74.209999999999994 111.073 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -114.82 112.36 22.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 73.109999999999999 110.929 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.493 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.6 OUTLIER -95.41 112.92 24.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 43.299999999999997 111.166 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.469 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -134.01 143.2 47.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.246 -0.434 . . . . 64.25 110.924 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -89.27 142.58 27.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 71.400000000000006 110.842 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . 0.786 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -141.66 166.65 24.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.156 -0.475 . . . . 72.329999999999998 111.148 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -55.88 160.55 4.27 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.674 0.749 . . . . 73.349999999999994 110.876 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -17.67 37.19 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.632 2.222 . . . . 62.140000000000001 112.358 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -76.13 -40.45 52.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 71.340000000000003 110.955 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.466 HG11 HD21 ' A' ' 548' ' ' LEU . 82.7 t -59.22 137.33 21.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 72.219999999999999 111.091 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -133.65 175.65 9.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 60.229999999999997 110.904 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 85.1 t -51.92 -47.76 40.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.463 . . . . 61.420000000000002 111.146 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -54.12 -39.67 66.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 65.439999999999998 110.901 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 85.5 m -67.01 -43.13 83.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 74.310000000000002 111.143 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.698 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.4 mt -62.63 -51.08 68.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.45 . . . . 73.129999999999995 110.927 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -64.42 -36.28 83.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 74.120000000000005 110.897 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -63.95 -45.71 87.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 71.340000000000003 110.869 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -70.08 -36.13 74.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 74.420000000000002 110.856 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.597 HD12 HD11 ' A' ' 512' ' ' ILE . 43.4 mt -62.89 -52.93 61.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.166 -0.47 . . . . 71.030000000000001 110.947 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -68.71 -38.01 79.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.471 . . . . 75.319999999999993 110.852 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.88 -47.51 84.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.549999999999997 110.934 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -67.82 -25.08 65.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 74.540000000000006 110.908 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 113.96 -18.28 19.23 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.754 -0.736 . . . . 71.010000000000005 112.505 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -62.96 160.28 39.4 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.655 0.74 . . . . 72.430000000000007 110.867 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 91.31 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 65.420000000000002 112.303 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -108.76 -30.17 3.84 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.733 -0.746 . . . . 70.420000000000002 112.518 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -62.73 -51.96 65.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.768 0.318 . . . . 71.099999999999994 110.908 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -75.37 -29.89 60.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 72.239999999999995 110.918 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.618 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -57.43 168.66 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 50.539999999999999 111.119 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.01 111.13 24.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 72.200000000000003 111.109 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.698 HD13 ' HB3' ' A' ' 496' ' ' LEU . 53.8 mt -99.47 134.66 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 111.14 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 4.0 m -134.68 155.24 50.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.182 -0.463 . . . . 70.030000000000001 111.105 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -102.85 143.99 31.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 74.030000000000001 110.922 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . 0.529 HG11 ' OE2' ' A' ' 524' ' ' GLU . 91.0 t -136.96 127.01 39.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 75.140000000000001 111.115 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -80.98 99.13 8.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 74.140000000000001 110.899 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.573 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -79.62 160.26 70.05 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.573 0.701 . . . . 54.109999999999999 111.081 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.573 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.2 Cg_endo -69.7 74.47 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.681 2.254 . . . . 73.409999999999997 112.365 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.561 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.1 t -177.32 139.23 0.25 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 73.420000000000002 111.151 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.0 24.98 6.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 50.329999999999998 111.105 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.19 -35.49 2.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 60.32 111.082 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.561 ' O ' HG23 ' A' ' 519' ' ' THR . 7.9 m-85 -136.83 161.41 36.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 72.510000000000005 110.891 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -123.75 155.56 37.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 72.400000000000006 110.895 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . 0.529 ' OE2' HG11 ' A' ' 515' ' ' VAL . 33.2 tt0 -90.55 144.46 25.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 72.019999999999996 110.887 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.786 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 90.4 m-85 -130.2 124.55 32.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 74.400000000000006 110.866 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.518 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -101.14 105.09 16.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.114 -0.494 . . . . 64.409999999999997 110.926 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.538 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.02 123.81 48.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 71.540000000000006 111.096 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.53 ' O ' HD23 ' A' ' 529' ' ' LEU . 18.2 tttp -102.68 108.56 19.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 73.540000000000006 110.904 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.618 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.4 mt -132.06 154.45 81.69 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.622 0.725 . . . . 74.519999999999996 110.89 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 162.14 43.2 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.682 2.254 . . . . 64.430000000000007 112.333 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 107.28 1.83 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.676 2.251 . . . . 62.549999999999997 112.362 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 5.1 mt -109.85 -171.03 1.76 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.235 -0.439 . . . . 72.099999999999994 110.928 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.01 153.69 41.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 74.239999999999995 110.871 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -52.09 -45.86 65.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.146 -0.479 . . . . 74.030000000000001 110.867 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -60.05 -37.46 79.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.176 -0.466 . . . . 73.310000000000002 110.903 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -65.65 -57.47 8.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 72.0 110.849 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -53.25 -46.43 69.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 74.319999999999993 110.892 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -67.02 -38.8 86.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 73.430000000000007 110.96 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -64.08 -46.4 84.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 75.349999999999994 110.887 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.12 -51.06 63.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.48 . . . . 75.540000000000006 110.911 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -58.34 -49.05 78.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 73.200000000000003 110.896 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -58.76 -53.73 55.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 72.540000000000006 110.872 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.1 mt -52.75 -43.66 65.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 44.329999999999998 110.894 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.31 -56.39 22.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 64.319999999999993 110.898 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.58 -13.23 60.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 61.409999999999997 111.091 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.6 t -79.55 -56.84 4.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 64.019999999999996 110.873 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -88.37 -52.16 5.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 73.409999999999997 110.91 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.466 HD21 HG11 ' A' ' 491' ' ' VAL . 1.0 OUTLIER -67.96 -12.17 60.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 63.409999999999997 110.905 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt 57.57 23.46 9.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 72.239999999999995 110.877 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -64.58 -179.55 0.5 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 53.439999999999998 111.1 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 90.5 m -144.71 110.88 5.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 72.510000000000005 111.188 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.8 t -57.04 118.87 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 72.030000000000001 111.172 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 55.8 mt -99.75 -47.7 4.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 73.010000000000005 110.874 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.53 173.45 16.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 71.510000000000005 111.106 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 6.1 p -165.49 149.95 8.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 74.25 110.85 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.1 -0.5 . . . . 73.099999999999994 110.904 -179.995 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.295 0 N-CA-C 112.482 -0.247 . . . . 72.140000000000001 112.482 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . 0.409 HG23 ' O ' ' A' ' 556' ' ' GLU . 7.1 m -122.84 107.54 11.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.776 0.322 . . . . 62.32 111.141 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.3 130.09 42.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 54.119999999999997 111.128 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -120.32 110.53 16.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 74.5 110.902 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.8 m -94.26 111.35 23.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 74.340000000000003 111.18 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.495 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -130.31 143.16 50.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 70.329999999999998 110.962 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.516 ' HB2' HD11 ' A' ' 553' ' ' LEU . 12.1 ttt180 -89.67 148.02 23.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 73.510000000000005 110.828 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . 0.737 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -153.35 169.64 22.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 74.239999999999995 111.102 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -62.6 160.54 34.06 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.646 0.736 . . . . 63.340000000000003 110.9 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -17.6 37.37 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.67 2.247 . . . . 65.340000000000003 112.358 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 38.8 m-20 -69.18 -45.73 69.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 72.430000000000007 110.913 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.522 HG11 HD21 ' A' ' 548' ' ' LEU . 42.7 t -65.22 129.56 29.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 71.219999999999999 111.127 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -124.16 177.29 5.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.209999999999994 110.886 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.458 HG13 ' HB ' ' A' ' 512' ' ' ILE . 93.8 t -51.7 -48.07 37.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 71.310000000000002 111.137 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -52.02 -41.05 61.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 74.450000000000003 110.899 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 95.4 m -68.95 -39.55 79.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 62.020000000000003 111.145 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.743 ' HB3' HD13 ' A' ' 512' ' ' ILE . 10.2 mt -64.03 -51.08 65.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 54.420000000000002 110.916 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -65.09 -40.95 95.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 75.430000000000007 110.85 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -61.34 -43.27 99.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 64.420000000000002 110.828 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -70.51 -37.75 74.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 73.319999999999993 110.932 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.569 HD12 HD11 ' A' ' 512' ' ' ILE . 33.9 mt -61.33 -51.82 67.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 71.129999999999995 110.89 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -69.62 -37.98 77.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 74.409999999999997 110.879 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -57.39 -48.96 77.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.485 . . . . 61.310000000000002 110.897 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.666 ' NZ ' HD22 ' A' ' 543' ' ' LEU . 17.2 mmtp -67.36 -24.05 65.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.191 -0.459 . . . . 63.030000000000001 110.89 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.1 -18.3 18.85 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.725 -0.75 . . . . 53.149999999999999 112.473 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.406 ' CD2' HD22 ' A' ' 540' ' ' LEU . 18.5 m-85 -64.54 160.21 53.98 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.682 0.753 . . . . 73.439999999999998 110.844 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 96.06 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.689 2.259 . . . . 63.030000000000001 112.357 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.76 -41.23 0.94 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.746 -0.74 . . . . 75.219999999999999 112.506 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -40.28 84.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.71 0.291 . . . . 74.439999999999998 110.877 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -83.75 -26.37 29.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 73.209999999999994 110.896 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.614 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -66.28 173.17 3.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 62.549999999999997 111.108 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.02 113.01 30.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 74.420000000000002 111.129 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.743 HD13 ' HB3' ' A' ' 496' ' ' LEU . 46.6 mt -102.29 132.96 47.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 62.229999999999997 111.096 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -127.76 141.77 51.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.14 -0.482 . . . . 71.239999999999995 111.154 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -92.92 126.15 37.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.266 -0.424 . . . . 74.140000000000001 110.921 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 92.8 t -116.35 99.22 7.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 62.229999999999997 111.118 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.24 113.71 10.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 64.340000000000003 110.892 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -94.3 160.31 32.17 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.588 0.709 . . . . 63.43 111.091 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.2 Cg_endo -69.82 74.53 1.31 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.687 2.258 . . . . 63.100000000000001 112.305 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.5 t -177.0 137.17 0.23 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 52.340000000000003 111.171 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.77 28.1 3.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 74.400000000000006 111.116 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.43 -34.66 3.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 73.420000000000002 111.06 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.544 ' O ' HG23 ' A' ' 519' ' ' THR . 15.4 m-85 -147.97 166.37 27.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.417 . . . . 54.310000000000002 110.872 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -140.35 159.67 41.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 71.530000000000001 110.868 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . 0.424 ' HG2' HD12 ' A' ' 553' ' ' LEU . 9.3 mt-10 -93.24 141.47 28.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 34.43 110.881 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.737 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 94.4 m-85 -127.31 124.34 38.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 73.319999999999993 110.869 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.23 111.58 23.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.121 -0.491 . . . . 71.099999999999994 110.936 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.557 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.5 t -104.17 117.0 49.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 64.129999999999995 111.094 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.56 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 5.3 ttmm -97.87 109.3 22.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 110.899 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.614 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.5 mt -131.71 154.38 81.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.657 0.741 . . . . 72.25 110.893 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 162.17 43.11 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.661 2.241 . . . . 72.430000000000007 112.352 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 105.28 1.47 Allowed 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.648 2.232 . . . . 73.299999999999997 112.361 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.7 mt -107.32 -171.06 1.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 74.099999999999994 110.937 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 46.4 t -71.18 151.24 44.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 52.509999999999998 110.862 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.93 -47.54 64.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 75.540000000000006 110.877 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -58.38 -41.05 83.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.162 -0.472 . . . . 73.120000000000005 110.913 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -64.44 -53.32 50.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 61.229999999999997 110.894 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 8.9 mtt85 -53.28 -52.99 57.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 73.129999999999995 110.908 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.2 mt -63.85 -34.42 77.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.183 -0.462 . . . . 73.430000000000007 110.894 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -65.86 -46.79 77.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 73.030000000000001 110.9 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.406 HD22 ' CD2' ' A' ' 505' ' ' PHE . 26.3 tp -64.86 -51.09 63.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.133 -0.485 . . . . 75.310000000000002 110.913 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -56.68 -49.39 75.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.455 . . . . 55.43 110.885 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -58.0 -53.41 58.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.462 . . . . 74.5 110.898 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . 0.666 HD22 ' NZ ' ' A' ' 503' ' ' LYS . 9.3 mt -52.79 -43.27 65.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 71.099999999999994 110.912 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.55 -56.51 20.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 72.019999999999996 110.88 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.58 -13.23 60.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.119 -0.492 . . . . 61.25 111.073 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 23.2 t -79.55 -56.96 3.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 74.049999999999997 110.87 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -88.33 -52.2 5.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 64.140000000000001 110.875 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.522 HD21 HG11 ' A' ' 491' ' ' VAL . 1.9 tp -67.9 -12.28 60.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.129 -0.487 . . . . 70.439999999999998 110.893 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt 57.58 23.32 9.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 73.109999999999999 110.903 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -65.3 -179.73 0.64 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.437 . . . . 60.340000000000003 111.092 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 86.2 m -145.12 110.94 5.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.099999999999994 111.146 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 62.1 t -57.59 126.76 15.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 75.430000000000007 111.122 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . 0.516 HD11 ' HB2' ' A' ' 486' ' ' ARG . 82.5 mt -110.72 -48.21 3.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 71.530000000000001 110.923 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -144.27 168.89 18.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 61.329999999999998 111.133 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 84.5 p -169.48 143.67 2.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 55.039999999999999 110.893 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.409 ' O ' HG23 ' A' ' 481' ' ' THR . 18.9 mt-10 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 64.329999999999998 110.883 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.324 0 N-CA-C 112.47 -0.252 . . . . 51.399999999999999 112.47 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 93.2 m -119.4 113.35 20.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 74.439999999999998 111.161 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.715 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -98.2 123.2 42.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 64.340000000000003 111.127 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -111.48 112.35 24.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 71.340000000000003 110.92 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.501 HG23 HD22 ' A' ' 526' ' ' LEU . 0.8 OUTLIER -96.45 111.48 23.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.112 -0.495 . . . . 75.030000000000001 111.144 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.485 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -130.04 142.93 50.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 75.230000000000004 110.945 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.6 135.79 35.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 61.009999999999998 110.863 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -144.37 170.88 15.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 60.310000000000002 111.044 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -62.32 160.55 31.68 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.671 0.748 . . . . 74.209999999999994 110.87 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -19.7 35.76 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.717 2.278 . . . . 64.230000000000004 112.337 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -64.99 -46.85 79.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 75.319999999999993 110.904 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.404 HG11 HD21 ' A' ' 548' ' ' LEU . 54.1 t -64.32 121.79 14.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 73.420000000000002 111.122 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -117.28 177.26 4.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 54.100000000000001 110.91 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 83.3 t -52.15 -48.47 42.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 74.420000000000002 111.153 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -52.35 -43.88 64.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 62.329999999999998 110.87 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 38.6 m -66.84 -41.96 86.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.48 . . . . 74.25 111.171 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.778 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.7 mt -63.57 -50.88 67.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 72.400000000000006 110.956 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 27.6 ptt180 -64.64 -35.96 82.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 65.120000000000005 110.89 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -64.7 -45.57 86.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.169 -0.469 . . . . 61.130000000000003 110.843 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -70.03 -35.98 74.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 74.409999999999997 110.902 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.84 HD12 HD11 ' A' ' 512' ' ' ILE . 26.4 mt -63.6 -52.79 59.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 74.5 110.929 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -68.23 -38.0 81.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 64.439999999999998 110.891 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.22 -45.76 92.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 71.400000000000006 110.868 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -68.57 -23.68 64.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 75.010000000000005 110.87 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.08 -19.07 18.24 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.694 -0.765 . . . . 22.510000000000002 112.475 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.546 ' CD2' HD22 ' A' ' 540' ' ' LEU . 15.5 m-85 -64.7 160.24 55.16 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.648 0.737 . . . . 70.099999999999994 110.86 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 97.43 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.705 2.27 . . . . 71.430000000000007 112.34 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -111.56 -35.03 1.96 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.728 -0.749 . . . . 72.510000000000005 112.474 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -64.66 -51.88 60.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.736 0.303 . . . . 73.530000000000001 110.906 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -71.66 -33.24 68.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 63.409999999999997 110.851 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.651 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -64.44 170.83 3.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.169 -0.469 . . . . 72.400000000000006 111.082 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.0 111.67 26.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 52.219999999999999 111.162 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.84 HD11 HD12 ' A' ' 500' ' ' LEU . 44.4 mt -97.53 119.89 46.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 72.319999999999993 111.164 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.24 155.43 27.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 73.239999999999995 111.128 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -114.71 142.24 46.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 54.32 110.902 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 61.8 t -134.55 113.42 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 72.209999999999994 111.156 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.19 102.18 1.63 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.135 -0.484 . . . . 70.340000000000003 110.887 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.578 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -74.0 160.27 82.15 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.616 0.722 . . . . 71.120000000000005 111.091 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.578 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.83 74.6 1.31 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.661 2.241 . . . . 75.420000000000002 112.335 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t 179.59 141.45 0.13 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 60.439999999999998 111.14 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -96.03 26.64 4.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 53.549999999999997 111.095 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.56 -35.06 3.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 71.439999999999998 111.083 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -140.03 178.57 7.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.441 . . . . 70.150000000000006 110.91 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 47.8 mtm180 -149.73 157.23 43.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 72.209999999999994 110.875 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -94.1 152.65 18.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 73.239999999999995 110.875 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.465 ' O ' HD23 ' A' ' 485' ' ' LEU . 80.7 m-85 -139.76 129.72 24.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 63.439999999999998 110.873 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.715 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -103.41 109.01 20.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.186 -0.461 . . . . 74.239999999999995 110.944 179.973 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.522 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.09 115.47 35.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 71.510000000000005 111.137 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.582 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 30.1 tttm -94.97 107.44 19.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.158 -0.474 . . . . 63.240000000000002 110.895 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.651 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -132.36 154.29 81.53 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.625 0.726 . . . . 72.310000000000002 110.934 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 162.12 43.31 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.704 2.269 . . . . 64.420000000000002 112.35 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 104.16 1.29 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.664 2.243 . . . . 72.239999999999995 112.326 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.2 mt -104.36 -171.3 1.9 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 73.049999999999997 110.943 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 30.5 m -70.24 150.87 45.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 72.219999999999999 110.841 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -52.29 -47.32 65.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 61.240000000000002 110.858 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -60.91 -49.95 75.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 45.210000000000001 110.878 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -55.24 -55.5 30.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 71.140000000000001 110.834 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 71.8 mtp180 -53.2 -52.99 57.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.467 . . . . 72.439999999999998 110.894 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 -35.2 72.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.191 -0.459 . . . . 74.319999999999993 110.907 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -65.92 -45.63 81.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 71.510000000000005 110.868 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.546 HD22 ' CD2' ' A' ' 505' ' ' PHE . 22.8 tp -63.38 -51.07 67.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.114 -0.494 . . . . 73.129999999999995 110.912 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -57.36 -50.02 74.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 75.209999999999994 110.893 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -57.96 -53.5 57.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.467 . . . . 65.129999999999995 110.853 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . 0.46 HD23 ' O ' ' A' ' 543' ' ' LEU . 2.0 tt -52.68 -43.23 65.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 71.109999999999999 110.898 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.66 -56.54 20.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 73.439999999999998 110.876 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.36 -13.32 60.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 63.32 111.09 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 25.1 t -79.64 -57.29 3.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 62.310000000000002 110.85 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -88.33 -52.29 5.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 52.119999999999997 110.912 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.404 HD21 HG11 ' A' ' 491' ' ' VAL . 0.4 OUTLIER -67.77 -12.44 60.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 72.450000000000003 110.966 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm 57.49 23.26 8.92 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.461 . . . . 62.109999999999999 110.882 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.29 178.7 1.43 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 63.219999999999999 111.142 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 42.4 m -143.89 110.98 5.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 55.119999999999997 111.144 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.9 t -58.18 104.01 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 74.219999999999999 111.145 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 25.1 mt -81.49 -39.08 25.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 71.209999999999994 110.926 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.59 173.2 13.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 74.450000000000003 111.083 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 1.3 t -166.06 155.81 12.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 72.040000000000006 110.87 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.566 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 7.0 pt-20 . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.47 . . . . 64.219999999999999 110.884 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.293 0 N-CA-C 112.503 -0.239 . . . . 51.420000000000002 112.503 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 92.1 m -122.04 110.72 16.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.8 0.333 . . . . 73.340000000000003 111.168 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.836 ' HB1' HD21 ' A' ' 526' ' ' LEU . . . -94.6 142.6 27.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 70.420000000000002 111.069 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -133.89 108.92 8.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 72.409999999999997 110.899 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.58 ' OG1' HD23 ' A' ' 526' ' ' LEU . 2.5 m -93.96 119.19 32.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 72.510000000000005 111.185 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.426 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.3 pt? -131.3 156.55 45.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 74.150000000000006 110.93 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -106.17 150.07 26.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 71.519999999999996 110.839 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -157.31 171.69 19.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 51.32 111.088 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.24 160.6 56.57 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.653 0.739 . . . . 72.420000000000002 110.881 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 -15.23 36.72 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.663 2.242 . . . . 53.219999999999999 112.338 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -62.82 -50.74 69.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.219 -0.446 . . . . 72.430000000000007 110.872 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.36 148.64 6.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 43.32 111.112 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -137.32 172.97 12.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.484 . . . . 73.450000000000003 110.875 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.429 HG22 ' HE2' ' A' ' 525' ' ' PHE . 87.2 t -51.41 -50.01 29.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 64.140000000000001 111.1 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -53.27 -40.39 64.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 73.439999999999998 110.918 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.4 m -68.36 -41.4 80.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 53.210000000000001 111.106 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.668 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.6 mt -60.51 -51.24 70.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.243 -0.435 . . . . 72.120000000000005 110.921 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -64.73 -42.95 94.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 74.409999999999997 110.902 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -59.85 -38.05 81.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.466 . . . . 75.25 110.835 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . 0.522 ' HE1' HD22 ' A' ' 543' ' ' LEU . 9.4 t80 -72.04 -44.61 63.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 73.129999999999995 110.863 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 40.1 mt -57.02 -48.89 77.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.464 . . . . 72.129999999999995 110.939 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -71.5 -37.99 71.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 75.140000000000001 110.88 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -55.28 -49.19 72.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 64.030000000000001 110.868 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.35 -25.92 67.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.468 . . . . 61.340000000000003 110.939 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 112.44 -7.29 26.5 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.748 -0.739 . . . . 62.210000000000001 112.495 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.615 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.6 m-85 -71.45 160.31 82.95 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.656 0.741 . . . . 54.100000000000001 110.87 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . 0.514 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 54.0 Cg_endo -69.73 79.93 0.91 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.667 2.245 . . . . 65.349999999999994 112.368 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -95.81 -37.18 5.05 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.748 -0.739 . . . . 63.140000000000001 112.47 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 11.5 pttp -59.34 -43.62 92.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.771 0.319 . . . . 75.140000000000001 110.875 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -81.18 -33.31 33.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 73.25 110.846 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.595 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -54.87 169.64 0.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 61.219999999999999 111.107 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 34.0 t -127.11 110.83 23.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 74.430000000000007 111.144 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.668 HD13 ' HB3' ' A' ' 496' ' ' LEU . 56.5 mt -92.91 128.76 44.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 71.420000000000002 111.12 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.95 136.54 52.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 72.349999999999994 111.138 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -99.16 132.93 44.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 72.510000000000005 110.881 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 33.1 t -139.54 111.42 5.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 72.329999999999998 111.105 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.78 98.52 8.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 74.040000000000006 110.896 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.6 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -65.08 161.22 50.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.609 0.718 . . . . 74.209999999999994 111.112 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.6 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.72 71.13 1.52 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.699 2.266 . . . . 72.219999999999999 112.372 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.8 t 177.81 136.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 74.549999999999997 111.161 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -93.96 38.63 1.08 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 64.409999999999997 111.064 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -124.42 -35.28 2.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 73.439999999999998 111.092 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -139.85 177.26 8.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.277 -0.42 . . . . 74.540000000000006 110.906 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.45 152.65 44.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 63.539999999999999 110.911 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . 0.41 ' HG2' HD12 ' A' ' 553' ' ' LEU . 9.7 mt-10 -111.67 130.97 55.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 75.340000000000003 110.876 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.429 ' HE2' HG22 ' A' ' 493' ' ' VAL . 6.0 m-85 -132.93 135.41 45.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 71.200000000000003 110.87 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.836 HD21 ' HB1' ' A' ' 482' ' ' ALA . 2.6 tm? -103.92 112.22 25.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 64.299999999999997 110.893 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.796 HG12 HD21 ' A' ' 529' ' ' LEU . 14.5 t -95.28 111.08 25.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 71.299999999999997 111.141 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.474 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 14.1 tttm -87.76 115.18 25.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 72.120000000000005 110.904 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.796 HD21 HG12 ' A' ' 527' ' ' VAL . 6.1 mt -131.78 154.88 81.92 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.644 0.735 . . . . 73.209999999999994 110.899 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 529' ' ' LEU . 53.9 Cg_endo -69.71 162.73 40.92 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.707 2.271 . . . . 65.310000000000002 112.379 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 103.91 1.23 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.698 2.266 . . . . 70.349999999999994 112.392 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.0 mt -107.22 -170.96 1.79 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 73.510000000000005 110.935 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.3 t -71.83 150.43 44.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 64.120000000000005 110.874 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -48.92 64.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 64.540000000000006 110.904 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -60.55 -48.41 81.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.888 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 49.4 mmm-85 -54.47 -57.96 9.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 62.310000000000002 110.885 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -52.86 -52.58 56.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 62.340000000000003 110.908 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mt -56.36 -37.12 69.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 64.0 110.928 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -64.84 -46.16 83.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 64.230000000000004 110.872 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.615 HD22 ' CD2' ' A' ' 505' ' ' PHE . 24.9 tp -60.91 -51.13 70.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 74.140000000000001 110.907 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.36 -50.33 73.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 64.439999999999998 110.857 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -58.0 -51.88 67.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.140000000000001 110.867 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . 0.522 HD22 ' HE1' ' A' ' 499' ' ' PHE . 2.6 tt -52.83 -44.78 66.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.229 -0.441 . . . . 74.010000000000005 110.88 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -60.05 -56.42 21.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 71.420000000000002 110.898 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.23 -13.14 59.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 73.129999999999995 111.103 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 23.2 t -79.63 -57.77 3.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 75.310000000000002 110.803 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -88.42 -52.12 5.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.093 -0.503 . . . . 73.209999999999994 110.874 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.82 -12.51 60.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.319999999999993 110.912 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt 57.09 23.39 8.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.185 -0.462 . . . . 63.210000000000001 110.924 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -68.65 176.93 2.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 64.200000000000003 111.071 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.7 m -145.09 110.96 5.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 63.109999999999999 111.098 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.5 t -54.14 135.11 16.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 64.129999999999995 111.1 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . 0.41 HD12 ' HG2' ' A' ' 524' ' ' GLU . 77.6 mt -120.79 -47.64 2.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 55.039999999999999 110.877 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . 0.546 ' HB3' ' HB ' ' A' ' 484' ' ' THR . . . -133.88 165.84 24.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 65.120000000000005 111.069 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 80.3 p -171.69 138.48 1.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 53.409999999999997 110.84 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.558 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 6.0 pt-20 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 110.888 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.296 0 N-CA-C 112.476 -0.249 . . . . 60.140000000000001 112.476 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 94.4 m -128.72 110.26 12.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.746 0.308 . . . . 74.120000000000005 111.154 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.423 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -96.81 130.1 44.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 72.010000000000005 111.094 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -117.56 116.45 27.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.217 -0.447 . . . . 75.409999999999997 110.923 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -98.81 110.04 22.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 72.099999999999994 111.158 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.488 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.9 pt? -133.37 145.64 50.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 62.420000000000002 110.89 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -89.29 137.72 32.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 72.319999999999993 110.911 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . 0.575 ' HB3' ' CD2' ' A' ' 525' ' ' PHE . . . -133.27 167.09 21.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 74.230000000000004 111.097 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -65.35 160.61 57.32 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.667 0.746 . . . . 71.430000000000007 110.862 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -12.79 33.6 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 2.251 . . . . 51.020000000000003 112.334 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -81.78 -37.29 27.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 64.530000000000001 110.861 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 87.8 t -70.75 120.67 19.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 60.100000000000001 111.143 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -113.49 178.72 4.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 73.230000000000004 110.883 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 54.1 t -53.46 -48.66 57.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 70.230000000000004 111.146 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -51.88 -42.08 62.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 64.25 110.875 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 69.6 m -67.84 -39.97 83.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.476 . . . . 64.140000000000001 111.139 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.574 ' HB3' HD13 ' A' ' 512' ' ' ILE . 2.3 mt -61.87 -50.94 70.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 70.219999999999999 110.899 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -64.79 -42.21 95.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.459 . . . . 74.019999999999996 110.859 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -60.04 -40.51 89.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.430000000000007 110.885 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . 0.563 ' HE1' HD22 ' A' ' 543' ' ' LEU . 15.0 t80 -70.9 -43.27 68.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 63.340000000000003 110.871 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 34.1 mt -57.78 -49.52 76.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 72.120000000000005 110.881 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.79 -37.96 73.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 71.409999999999997 110.872 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -56.38 -49.18 75.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 71.109999999999999 110.865 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -24.52 65.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 72.530000000000001 110.914 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -16.88 20.23 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.755 -0.736 . . . . 53.509999999999998 112.491 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.539 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.9 m-85 -60.94 160.24 21.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.658 0.742 . . . . 64.120000000000005 110.876 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . 0.498 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 53.7 Cg_endo -69.73 86.42 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.724 2.283 . . . . 60.340000000000003 112.333 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -102.04 -30.54 5.69 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.747 -0.739 . . . . 72.219999999999999 112.452 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -63.94 -42.22 97.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.766 0.317 . . . . 50.409999999999997 110.871 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -85.53 -27.19 25.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 73.0 110.854 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.626 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -62.34 165.6 5.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 62.439999999999998 111.104 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.83 111.28 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 73.5 111.092 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.574 HD13 ' HB3' ' A' ' 496' ' ' LEU . 54.3 mt -92.8 139.5 17.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 73.439999999999998 111.128 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -135.47 143.68 45.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 73.030000000000001 111.122 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -99.3 143.23 29.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 74.310000000000002 110.883 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 76.8 t -139.01 115.11 9.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.452 . . . . 62.329999999999998 111.119 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -74.63 127.3 32.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 63.549999999999997 110.868 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.586 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -110.41 160.22 29.25 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.563 0.697 . . . . 70.530000000000001 111.135 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.586 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.9 Cg_endo -69.76 74.48 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.692 2.262 . . . . 60.450000000000003 112.356 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.576 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.0 t 179.17 141.58 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.462 . . . . 73.340000000000003 111.122 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -99.56 27.41 5.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 63.020000000000003 111.089 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.48 -35.02 3.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 43.219999999999999 111.068 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.576 ' O ' HG23 ' A' ' 519' ' ' THR . 13.1 m-85 -146.8 159.98 42.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.275 -0.421 . . . . 73.510000000000005 110.943 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 4.6 ptt180 -131.18 165.02 24.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.09 -0.505 . . . . 74.030000000000001 110.867 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -92.84 139.94 30.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 64.019999999999996 110.869 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.575 ' CD2' ' HB3' ' A' ' 487' ' ' ALA . 10.8 m-85 -128.83 122.86 31.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.486 . . . . 71.409999999999997 110.851 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.41 HD22 ' HA ' ' A' ' 526' ' ' LEU . 0.5 OUTLIER -102.31 105.54 16.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.104 -0.498 . . . . 64.409999999999997 110.916 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.54 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.4 t -96.82 133.52 37.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 63.25 111.084 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.492 ' O ' HD23 ' A' ' 529' ' ' LEU . 18.9 tttp -108.55 108.1 18.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 61.439999999999998 110.929 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.626 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.6 mt -131.17 154.44 81.99 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.577 0.703 . . . . 75.519999999999996 110.898 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.16 43.14 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.678 2.252 . . . . 72.510000000000005 112.383 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 113.92 3.53 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.637 2.224 . . . . 74.409999999999997 112.354 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 1.2 mt -115.37 -171.19 1.91 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 60.0 110.907 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.32 154.98 38.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 62.130000000000003 110.848 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . 0.497 ' N ' HH21 ' A' ' 537' ' ' ARG . 4.6 m-20 -51.67 -47.11 63.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.101 -0.5 . . . . 70.109999999999999 110.855 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -59.78 -50.17 74.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 71.230000000000004 110.863 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -50.88 -59.11 4.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 71.439999999999998 110.897 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . 0.497 HH21 ' N ' ' A' ' 534' ' ' ASP . 79.4 mtm180 -53.51 -52.51 59.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 72.310000000000002 110.864 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.38 -39.32 67.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 73.239999999999995 110.931 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -67.23 -47.34 71.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.467 . . . . 72.430000000000007 110.879 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.539 HD22 ' CD2' ' A' ' 505' ' ' PHE . 21.7 tp -60.01 -51.09 71.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.140000000000001 110.92 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -59.47 -48.33 82.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 73.299999999999997 110.939 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 23.8 mtp180 -60.13 -53.52 56.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 73.510000000000005 110.869 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . 0.563 HD22 ' HE1' ' A' ' 499' ' ' PHE . 4.0 tt -52.9 -44.03 66.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 74.340000000000003 110.902 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.39 -56.48 20.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 73.340000000000003 110.875 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.36 -13.2 60.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 72.530000000000001 111.103 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.52 -57.34 3.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 72.409999999999997 110.898 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -88.33 -52.24 5.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.495 . . . . 71.109999999999999 110.914 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.1 tp -67.88 -12.35 60.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 33.130000000000003 110.945 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt 57.44 23.22 8.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 71.549999999999997 110.893 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.99 179.44 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 63.200000000000003 111.113 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 61.5 m -139.67 110.99 7.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 43.219999999999999 111.188 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.41 114.52 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 74.109999999999999 111.145 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 12.2 mt -90.92 -51.66 5.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 74.439999999999998 110.856 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -162.0 174.21 13.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 34.350000000000001 111.092 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 90.7 p -163.06 148.43 11.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 74.310000000000002 110.887 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.423 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 11.6 pt-20 . . . . . 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 70.030000000000001 110.889 -179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.338 0 N-CA-C 112.478 -0.249 . . . . 75.420000000000002 112.478 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 25.6 m -131.6 107.35 8.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.8 0.333 . . . . 73.219999999999999 111.162 -179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.595 ' HB3' ' CG ' ' A' ' 556' ' ' GLU . . . -95.0 115.15 27.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 74.030000000000001 111.084 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -104.69 113.03 26.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 74.420000000000002 110.93 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 5.2 m -94.87 110.09 22.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.129 -0.487 . . . . 65.400000000000006 111.127 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.458 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -134.41 143.28 47.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 70.349999999999994 110.939 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.415 ' HD3' HD11 ' A' ' 553' ' ' LEU . 24.3 mtp180 -90.21 142.15 28.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 74.420000000000002 110.834 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . 0.485 ' HB3' ' CD2' ' A' ' 525' ' ' PHE . . . -137.15 168.54 19.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.172 -0.467 . . . . 73.129999999999995 111.065 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -63.94 160.57 45.67 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.617 0.722 . . . . 64.019999999999996 110.908 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -14.12 35.49 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.666 2.244 . . . . 75.430000000000007 112.322 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -80.17 -37.33 33.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 71.409999999999997 110.904 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 63.9 t -69.2 125.64 27.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.453 . . . . 74.120000000000005 111.169 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -117.99 175.35 5.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 43.210000000000001 110.873 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 60.9 t -51.79 -48.9 37.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 74.340000000000003 111.114 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -52.0 -40.38 60.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 54.149999999999999 110.918 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 95.2 m -66.47 -43.23 86.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.134 -0.485 . . . . 72.400000000000006 111.111 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.646 ' CB ' HD13 ' A' ' 512' ' ' ILE . 7.2 mt -61.78 -51.04 69.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 64.340000000000003 110.924 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -65.02 -35.09 80.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 72.540000000000006 110.841 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 42.6 mtp180 -64.19 -45.09 89.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.244 -0.435 . . . . 74.310000000000002 110.859 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -71.15 -36.92 72.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 71.219999999999999 110.9 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.456 HD12 HD11 ' A' ' 512' ' ' ILE . 29.2 mt -62.11 -50.43 71.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 71.109999999999999 110.962 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -71.08 -37.87 72.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 70.239999999999995 110.873 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.09 -48.95 78.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 73.450000000000003 110.905 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -67.88 -24.05 65.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 72.549999999999997 110.865 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 113.91 -18.6 19.11 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.745 -0.741 . . . . 63.009999999999998 112.472 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.511 ' CD2' HD22 ' A' ' 540' ' ' LEU . 15.9 m-85 -60.74 160.24 20.92 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.684 0.754 . . . . 62.530000000000001 110.884 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . 0.462 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 53.8 Cg_endo -69.77 90.08 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.683 2.255 . . . . 61.200000000000003 112.362 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -104.95 -39.26 2.35 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.788 -0.72 . . . . 34.439999999999998 112.501 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 17.1 mtpp -57.25 -52.08 66.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.728 0.299 . . . . 75.25 110.883 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.14 -36.27 66.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.426 . . . . 71.420000000000002 110.893 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.636 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -54.14 167.06 0.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 65.239999999999995 111.1 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.72 111.12 24.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 63.310000000000002 111.163 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.646 HD13 ' CB ' ' A' ' 496' ' ' LEU . 74.7 mt -96.02 127.05 48.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 62.130000000000003 111.141 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 2.1 m -122.13 148.21 45.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 61.439999999999998 111.193 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -104.41 140.35 38.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 72.340000000000003 110.925 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 80.8 t -136.43 111.91 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 65.040000000000006 111.177 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.09 110.93 7.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 74.329999999999998 110.924 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -91.51 160.25 37.16 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.547 0.689 . . . . 61.310000000000002 111.104 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.561 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.6 Cg_endo -69.79 74.55 1.29 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.673 2.249 . . . . 74.219999999999999 112.346 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.62 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.9 t -177.04 137.37 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 73.319999999999993 111.149 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.42 25.8 4.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 55.409999999999997 111.101 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.38 -35.15 3.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 62.009999999999998 111.072 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.62 ' O ' HG23 ' A' ' 519' ' ' THR . 13.4 m-85 -144.58 166.77 24.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 72.200000000000003 110.906 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -136.32 160.23 39.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.492 . . . . 72.109999999999999 110.853 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -88.97 138.39 31.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 51.329999999999998 110.906 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.485 ' CD2' ' HB3' ' A' ' 487' ' ' ALA . 10.9 m-85 -128.76 122.2 30.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 54.140000000000001 110.881 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.5 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -99.3 104.82 16.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 74.219999999999999 110.905 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.578 HG12 HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.57 111.86 27.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 71.230000000000004 111.112 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.509 ' O ' HD23 ' A' ' 529' ' ' LEU . 17.3 ttmt -91.38 109.05 20.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.150000000000006 110.86 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.636 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.0 mt -132.53 154.42 81.52 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.618 0.723 . . . . 74.349999999999994 110.921 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 162.19 43.04 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.714 2.276 . . . . 72.519999999999996 112.349 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 103.88 1.23 Allowed 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.684 2.256 . . . . 74.019999999999996 112.344 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 5.0 mt -101.06 -171.34 1.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 74.209999999999994 110.884 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 30.0 t -71.12 151.25 44.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 72.310000000000002 110.875 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -51.75 -51.14 58.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 63.020000000000003 110.873 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -61.14 -45.41 94.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.436 . . . . 71.299999999999997 110.924 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 11.6 mmt180 -57.38 -58.07 9.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 64.140000000000001 110.87 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -52.82 -52.15 58.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 72.310000000000002 110.908 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.4 mt -56.86 -48.12 78.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 71.430000000000007 110.9 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.8 -41.63 74.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 72.299999999999997 110.908 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.511 HD22 ' CD2' ' A' ' 505' ' ' PHE . 34.5 tp -66.38 -39.71 89.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.136 -0.484 . . . . 64.230000000000004 110.904 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -61.23 -55.4 32.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 74.450000000000003 110.836 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 1.6 ptt85 -59.07 -47.83 83.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 75.219999999999999 110.849 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 5.5 tt -53.59 -47.34 70.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.439 . . . . 75.409999999999997 110.898 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -60.63 -56.04 26.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 73.109999999999999 110.867 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.48 -14.09 55.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 63.030000000000001 111.138 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.03 -59.28 2.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 75.430000000000007 110.798 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -86.23 -52.55 5.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 74.430000000000007 110.87 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.44 HD23 ' HB2' ' A' ' 550' ' ' ALA . 1.2 tp -67.53 -12.67 60.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.456 . . . . 61.039999999999999 110.93 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.27 23.2 8.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 72.129999999999995 110.9 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . 0.44 ' HB2' HD23 ' A' ' 548' ' ' LEU . . . -68.68 175.4 3.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 71.409999999999997 111.075 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 88.9 m -137.55 111.18 8.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 64.510000000000005 111.148 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.2 111.81 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 73.439999999999998 111.167 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . 0.415 HD11 ' HD3' ' A' ' 486' ' ' ARG . 12.1 mt -90.15 -51.96 5.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 54.549999999999997 110.881 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.4 175.12 13.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 74.150000000000006 111.09 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 91.9 p -163.72 139.34 6.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 64.230000000000004 110.837 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.595 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 3.7 pt-20 . . . . . 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 62.149999999999999 110.843 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 N-CA-C 112.498 -0.241 . . . . 52.329999999999998 112.498 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 1.6 m -123.94 109.21 13.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.776 0.322 . . . . 74.540000000000006 111.175 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . 0.74 ' HB3' ' CG ' ' A' ' 556' ' ' GLU . . . -94.87 121.98 37.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 32.43 111.103 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -115.95 114.6 24.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.439 . . . . 72.310000000000002 110.934 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.482 HG23 ' CD2' ' A' ' 526' ' ' LEU . 1.2 m -100.06 113.55 26.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.095 -0.502 . . . . 75.409999999999997 111.158 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.491 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -131.64 143.86 50.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 75.340000000000003 110.861 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -92.14 145.25 24.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.467 . . . . 71.140000000000001 110.846 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -148.66 169.76 19.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 72.420000000000002 111.139 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -64.97 160.8 52.97 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.657 0.741 . . . . 74.340000000000003 110.925 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -10.74 29.3 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.691 2.261 . . . . 74.450000000000003 112.385 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -73.85 -46.45 44.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 71.540000000000006 110.853 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . 0.631 HG11 HD21 ' A' ' 548' ' ' LEU . 67.0 t -66.92 138.86 22.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.109999999999999 111.121 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -133.73 179.71 6.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 64.200000000000003 110.903 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.6 t -51.54 -47.93 36.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 71.319999999999993 111.093 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -51.65 -39.99 59.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.400000000000006 110.879 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.2 m -71.31 -35.53 71.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 64.540000000000006 111.141 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.66 ' CB ' HD13 ' A' ' 512' ' ' ILE . 4.1 mt -67.32 -45.57 76.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 71.219999999999999 110.898 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -69.47 -46.26 67.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 74.219999999999999 110.898 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -64.12 -32.47 74.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 73.319999999999993 110.891 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -73.28 -46.99 46.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 72.120000000000005 110.85 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 43.4 mt -61.08 -42.53 98.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 75.030000000000001 110.941 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -73.05 -37.59 66.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 60.549999999999997 110.891 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -60.34 -48.98 79.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 72.400000000000006 110.88 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . 0.596 ' HE2' HD13 ' A' ' 543' ' ' LEU . 28.8 mmmt -68.97 -23.78 64.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 72.340000000000003 110.875 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.12 -17.6 19.41 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.746 -0.74 . . . . 70.450000000000003 112.493 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -63.05 160.16 41.11 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.593 0.711 . . . . 71.25 110.943 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 95.57 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 122.689 2.259 . . . . 64.209999999999994 112.325 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -111.15 -37.24 1.68 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.695 -0.764 . . . . 52.43 112.482 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -63.34 -42.56 98.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.791 0.329 . . . . 64.430000000000007 110.874 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -79.91 -38.43 32.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 73.420000000000002 110.938 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.624 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -55.94 171.44 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 73.430000000000007 111.115 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 56.4 t -127.08 118.08 49.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.272 -0.422 . . . . 62.43 111.159 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.66 HD13 ' CB ' ' A' ' 496' ' ' LEU . 50.7 mt -96.82 141.84 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 74.329999999999998 111.151 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.89 138.72 37.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.129999999999995 111.173 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.53 143.17 27.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 53.109999999999999 110.956 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 83.7 t -135.77 104.61 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 75.230000000000004 111.11 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 18.9 tm0? -73.84 102.08 3.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 65.400000000000006 110.894 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -81.92 160.23 63.98 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.595 0.712 . . . . 75.120000000000005 111.089 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.78 74.55 1.29 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.629 2.22 . . . . 71.239999999999995 112.356 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 4.4 t -175.05 139.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 72.230000000000004 111.187 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.63 25.18 6.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 71.129999999999995 111.083 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.85 -34.57 3.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 42.210000000000001 111.11 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -138.6 177.61 7.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.242 -0.435 . . . . 74.209999999999994 110.944 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 44.2 mtt85 -144.78 153.66 41.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 75.510000000000005 110.875 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . 0.415 ' HG2' HD12 ' A' ' 553' ' ' LEU . 9.8 mt-10 -92.27 138.74 31.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 64.040000000000006 110.878 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.474 ' CD1' HD11 ' A' ' 496' ' ' LEU . 9.6 m-85 -122.25 122.77 39.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.138 -0.483 . . . . 70.329999999999998 110.868 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.482 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -100.46 101.48 12.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 71.0 110.944 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.565 ' CG1' HD21 ' A' ' 529' ' ' LEU . 19.7 t -95.98 122.7 47.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 55.009999999999998 111.128 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.531 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 0.1 OUTLIER -100.63 109.65 21.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.478 . . . . 73.319999999999993 110.874 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.624 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -130.77 154.65 81.9 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.583 0.706 . . . . 75.349999999999994 110.915 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 162.41 42.18 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.66 2.24 . . . . 62.039999999999999 112.379 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 104.04 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.667 2.245 . . . . 73.420000000000002 112.346 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.6 mt -103.0 -171.0 1.87 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 65.310000000000002 110.895 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 21.3 m -75.69 152.59 37.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 62.0 110.853 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.64 -46.77 63.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 75.239999999999995 110.918 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.03 -43.1 99.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 73.239999999999995 110.915 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -62.0 -55.8 25.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 75.340000000000003 110.877 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 45.9 mtp180 -52.79 -53.15 52.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 70.150000000000006 110.895 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . 0.567 HD22 HH21 ' A' ' 542' ' ' ARG . 0.8 OUTLIER -55.38 -48.3 74.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 73.530000000000001 110.975 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -55.55 -41.84 73.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.230000000000004 110.948 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 30.4 tp -66.0 -39.2 90.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.082 -0.508 . . . . 74.420000000000002 110.901 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -61.74 -55.63 28.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.185 -0.461 . . . . 75.409999999999997 110.919 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . 0.567 HH21 HD22 ' A' ' 538' ' ' LEU . 17.2 ptp180 -58.55 -47.95 82.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.096 -0.502 . . . . 64.099999999999994 110.89 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . 0.596 HD13 ' HE2' ' A' ' 503' ' ' LYS . 12.2 mt -53.72 -47.92 70.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.239999999999995 110.945 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -59.62 -56.26 24.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.166 -0.47 . . . . 74.219999999999999 110.877 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.06 -13.54 58.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 73.239999999999995 111.082 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -59.03 2.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 74.409999999999997 110.889 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -88.2 -52.22 5.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 70.030000000000001 110.896 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . 0.631 HD21 HG11 ' A' ' 491' ' ' VAL . 0.1 OUTLIER -67.63 -12.73 61.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 73.549999999999997 110.991 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt 55.89 24.22 7.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 50.009999999999998 110.942 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.81 -179.94 3.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.232 -0.44 . . . . 72.329999999999998 111.104 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.7 m -145.05 111.37 5.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 72.219999999999999 111.096 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.5 t -52.08 120.23 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 65.019999999999996 111.138 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . 0.415 HD12 ' HG2' ' A' ' 524' ' ' GLU . 16.0 mt -99.0 -50.91 4.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 72.200000000000003 110.88 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -159.11 174.71 14.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.447 . . . . 72.349999999999994 111.131 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 51.1 p -161.04 163.51 31.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 63.0 110.857 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . 0.74 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 18.5 pt-20 . . . . . 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 73.219999999999999 110.88 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 N-CA-C 112.471 -0.251 . . . . 54.350000000000001 112.471 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 9.3 m -125.17 113.65 17.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.811 0.339 . . . . 52.329999999999998 111.133 -179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.06 121.18 36.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 65.120000000000005 111.096 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -114.01 110.18 19.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 70.310000000000002 110.921 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 484' ' ' THR . . . . . 0.488 HG23 HD22 ' A' ' 526' ' ' LEU . 1.5 m -97.77 120.21 37.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 64.150000000000006 111.123 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 485' ' ' LEU . . . . . 0.468 HD23 ' H ' ' A' ' 485' ' ' LEU . 2.1 pt? -136.96 153.2 50.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 55.140000000000001 110.888 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 486' ' ' ARG . . . . . 0.529 ' HB2' HD11 ' A' ' 553' ' ' LEU . 2.5 ttm180 -98.89 137.87 36.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.454 . . . . 63.439999999999998 110.864 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 487' ' ' ALA . . . . . 0.705 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -146.52 168.06 22.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 63.329999999999998 111.104 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.56 160.75 49.76 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.608 0.718 . . . . 63.240000000000002 110.9 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -15.86 37.08 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.653 2.235 . . . . 75.400000000000006 112.322 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -66.64 -47.48 72.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 74.030000000000001 110.847 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 38.7 t -67.87 129.63 32.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 64.329999999999998 111.123 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -122.6 177.77 5.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 72.230000000000004 110.844 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.582 HG13 ' HB ' ' A' ' 512' ' ' ILE . 87.1 t -51.5 -49.53 32.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 73.219999999999999 111.132 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -50.78 -40.36 54.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 73.530000000000001 110.841 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 91.5 m -70.57 -35.14 72.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 73.239999999999995 111.137 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 496' ' ' LEU . . . . . 0.514 ' CB ' HD13 ' A' ' 512' ' ' ILE . 4.5 mt -68.02 -44.19 77.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 73.010000000000005 110.887 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -69.39 -45.04 70.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 65.450000000000003 110.916 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -66.48 -32.78 74.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 74.439999999999998 110.876 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -73.6 -42.67 61.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 74.230000000000004 110.916 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 52.9 mt -65.53 -41.56 92.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 70.140000000000001 110.934 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -73.07 -37.76 66.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.129999999999995 110.88 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -64.02 -46.32 84.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 74.530000000000001 110.877 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -65.88 -24.76 66.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 73.219999999999999 110.941 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.01 -16.06 20.73 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.717 -0.754 . . . . 74.219999999999999 112.487 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 505' ' ' PHE . . . . . 0.416 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.2 m-85 -71.94 160.27 83.15 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.66 0.743 . . . . 73.519999999999996 110.877 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 98.44 0.69 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.676 2.25 . . . . 51.340000000000003 112.313 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -116.27 -34.59 1.31 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.779 -0.724 . . . . 43.32 112.495 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 3.7 mtmp? -62.39 -50.56 71.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.779 0.323 . . . . 72.349999999999994 110.907 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -73.02 -32.85 65.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 73.319999999999993 110.897 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 510' ' ' ALA . . . . . 0.618 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -59.75 172.94 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.138 -0.483 . . . . 51.409999999999997 111.097 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.03 119.37 52.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.225 -0.443 . . . . 74.230000000000004 111.145 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.582 ' HB ' HG13 ' A' ' 493' ' ' VAL . 44.2 mt -99.28 141.9 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 74.439999999999998 111.141 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.06 134.3 36.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 75.319999999999993 111.128 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 12.5 pm0 -94.89 142.74 27.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 72.200000000000003 110.949 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.8 t -138.21 114.33 10.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 74.340000000000003 111.183 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.08 113.01 10.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 75.099999999999994 110.88 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 517' ' ' ALA . . . . . 0.577 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -91.76 160.34 36.43 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.616 0.722 . . . . 54.439999999999998 111.055 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 518' ' ' PRO . . . . . 0.577 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.9 Cg_endo -69.75 74.43 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.673 2.249 . . . . 75.530000000000001 112.375 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 519' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 522' ' ' TYR . 3.0 t -179.32 141.02 0.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 72.450000000000003 111.145 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -97.33 24.76 6.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.253 -0.431 . . . . 44.439999999999998 111.125 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.63 -35.67 2.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 64.420000000000002 111.041 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 522' ' ' TYR . . . . . 0.56 ' O ' HG23 ' A' ' 519' ' ' THR . 7.4 m-85 -137.58 168.14 20.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 74.209999999999994 110.887 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 10.6 mmt85 -140.67 160.03 40.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.094 -0.503 . . . . 63.119999999999997 110.884 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -90.52 139.48 30.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 64.409999999999997 110.89 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 525' ' ' PHE . . . . . 0.705 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 89.9 m-85 -128.47 124.63 36.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.486 . . . . 61.210000000000001 110.859 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 526' ' ' LEU . . . . . 0.488 HD22 HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -106.35 104.31 13.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.465 . . . . 71.140000000000001 110.907 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.547 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.2 t -96.86 127.04 49.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 65.510000000000005 111.154 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 528' ' ' LYS . . . . . 0.592 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 3.1 tmtm? -106.44 108.32 19.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 54.210000000000001 110.885 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 529' ' ' LEU . . . . . 0.618 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.3 mt -130.58 154.73 81.76 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.631 0.729 . . . . 43.340000000000003 110.873 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 162.39 42.28 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.675 2.25 . . . . 65.439999999999998 112.331 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 104.05 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.701 2.267 . . . . 51.109999999999999 112.337 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.7 mt -103.78 -170.9 1.84 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 63.119999999999997 110.961 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 32.5 t -72.98 151.09 41.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 51.329999999999998 110.865 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.06 -46.31 65.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 44.310000000000002 110.82 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -61.11 -53.55 55.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 55.350000000000001 110.888 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 42.2 mmt180 -52.04 -55.79 18.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.458 . . . . 75.219999999999999 110.885 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 -52.93 -53.2 52.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 65.030000000000001 110.878 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.2 -39.8 70.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 74.140000000000001 110.933 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -64.21 -42.17 96.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.48 . . . . 74.540000000000006 110.885 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 540' ' ' LEU . . . . . 0.416 HD22 ' CD2' ' A' ' 505' ' ' PHE . 22.7 tp -64.01 -51.17 65.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 70.049999999999997 110.871 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . 0.434 ' OE1' HG22 ' A' ' 552' ' ' VAL . 62.6 mm-40 -57.28 -50.79 71.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 74.299999999999997 110.872 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -57.92 -52.52 65.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 74.329999999999998 110.881 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.5 mt -52.75 -43.5 65.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 72.120000000000005 110.925 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -60.86 -56.6 19.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 73.519999999999996 110.858 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.09 -13.45 60.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 74.219999999999999 111.091 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.7 -57.78 3.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.217 -0.447 . . . . 72.430000000000007 110.89 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -88.41 -52.32 5.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 62.409999999999997 110.863 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.71 -12.67 61.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 74.329999999999998 110.913 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 57.04 23.33 8.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 75.019999999999996 110.915 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -69.32 179.68 1.92 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 71.420000000000002 111.119 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 3.0 m -144.09 110.94 5.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 75.530000000000001 111.13 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 552' ' ' VAL . . . . . 0.434 HG22 ' OE1' ' A' ' 541' ' ' GLU . 39.2 t -53.64 115.59 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 65.230000000000004 111.092 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 553' ' ' LEU . . . . . 0.529 HD11 ' HB2' ' A' ' 486' ' ' ARG . 72.1 mt -92.51 -45.7 8.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 74.25 110.955 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.11 174.58 12.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 111.087 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 63.7 p -169.05 149.85 4.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 71.219999999999999 110.852 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 75.510000000000005 110.91 -179.986 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 22.3 mtp . . . . . 0 C--O 1.232 0.136 0 CA-C-O 120.814 0.34 . . . . 71.209999999999994 110.893 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 7.2 p -159.68 135.85 1.95 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.243 -0.435 . . . . 73.340000000000003 111.115 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -109.38 172.4 16.1 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.706 -0.759 . . . . 64.219999999999999 112.469 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 87.8 m-85 -133.12 145.95 51.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.895 0.379 . . . . 73.540000000000006 110.861 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -139.65 153.55 47.33 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.129 -0.487 . . . . 74.349999999999994 110.918 -179.95 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 24.7 t80 -99.84 127.01 46.04 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.157 -0.474 . . . . 74.219999999999999 110.92 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 3.7 m -128.14 177.09 7.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 63.310000000000002 110.871 -179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 59.7 mt -101.45 142.14 16.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 73.150000000000006 111.085 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 23.0 t0 -161.95 115.71 1.86 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.155 -0.475 . . . . 74.409999999999997 110.886 179.835 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 42.7 m-85 -57.94 -27.86 63.77 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.209 -0.451 . . . . 62.140000000000001 110.894 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -86.47 171.63 10.96 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.14 -0.482 . . . . 75.019999999999996 111.146 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 164.24 99.01 0.13 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.755 -0.736 . . . . 64.230000000000004 112.544 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -143.23 136.45 7.02 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.768 -0.73 . . . . 70.230000000000004 112.518 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . 0.46 ' OG1' HG23 ' A' ' 557' ' ' THR . 82.1 m -129.34 110.61 12.07 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.802 0.334 . . . . 73.140000000000001 111.175 -179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.671 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -97.38 112.19 24.13 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.235 -0.438 . . . . 72.519999999999996 111.138 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 19.9 m-85 -101.29 118.59 37.29 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.211 -0.449 . . . . 71.049999999999997 110.93 -179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.471 HG23 ' CD2' ' A' ' 526' ' ' LEU . 1.0 OUTLIER -101.44 112.84 25.5 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.116 -0.493 . . . . 65.109999999999999 111.149 -179.972 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.484 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -132.6 142.91 49.35 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.256 -0.429 . . . . 61.5 110.922 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -90.42 146.02 24.48 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 70.099999999999994 110.875 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . 0.726 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -151.35 167.35 28.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.153 -0.476 . . . . 61.229999999999997 111.091 179.958 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -61.04 160.48 21.11 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.623 0.725 . . . . 73.329999999999998 110.875 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -23.61 30.6 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.689 2.259 . . . . 63.350000000000001 112.317 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 32.9 m-20 -63.56 -35.06 79.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 72.310000000000002 110.916 -180.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 46.5 t -73.81 132.94 32.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.154 -0.475 . . . . 75.209999999999994 111.136 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -127.88 177.67 6.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 74.340000000000003 110.879 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 91.1 t -51.72 -42.14 30.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.159 -0.473 . . . . 72.310000000000002 111.119 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 52.8 mt-10 -58.54 -41.21 85.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.22 -0.445 . . . . 73.540000000000006 110.892 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 34.8 m -66.31 -44.49 83.28 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.181 -0.463 . . . . 74.239999999999995 111.132 -179.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.608 ' HB3' HD13 ' A' ' 512' ' ' ILE . 7.4 mt -62.03 -51.0 69.8 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 75.140000000000001 110.914 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.3 ptp180 -64.32 -34.83 79.05 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 75.0 110.858 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 66.9 mtt180 -64.71 -46.38 82.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.185 -0.461 . . . . 73.409999999999997 110.89 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -70.27 -35.41 73.73 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.185 -0.461 . . . . 72.430000000000007 110.839 -179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.714 HD12 HD11 ' A' ' 512' ' ' ILE . 36.4 mt -63.61 -52.81 59.27 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.204 -0.453 . . . . 74.319999999999993 110.922 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -68.78 -37.96 79.69 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.209 -0.451 . . . . 71.510000000000005 110.919 179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -59.32 -48.27 82.25 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.487 . . . . 74.109999999999999 110.902 -179.933 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 60.2 mmtt -66.66 -24.85 66.34 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.179 -0.464 . . . . 73.109999999999999 110.897 179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -18.35 18.99 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.74 -0.743 . . . . 75.25 112.505 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.505 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.8 m-85 -62.21 160.25 32.95 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.657 0.741 . . . . 75.340000000000003 110.894 -179.883 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 90.3 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.653 2.235 . . . . 74.219999999999999 112.335 -179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -107.46 -26.08 5.79 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.702 -0.761 . . . . 61.119999999999997 112.478 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 9.3 mtpm? -68.05 -51.94 41.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.756 0.312 . . . . 71.150000000000006 110.891 -179.979 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 10.5 mt-10 -75.22 -33.9 61.42 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 61.32 110.867 179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.625 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -55.92 170.56 0.29 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.175 -0.466 . . . . 31.530000000000001 111.093 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.01 113.35 32.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.232 -0.44 . . . . 73.439999999999998 111.101 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.714 HD11 HD12 ' A' ' 500' ' ' LEU . 57.9 mt -100.05 126.74 53.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.124 -0.489 . . . . 73.299999999999997 111.128 179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -125.03 148.7 48.36 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 74.040000000000006 111.181 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -101.25 143.63 31.09 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.223 -0.444 . . . . 60.310000000000002 110.878 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 90.2 t -133.07 103.62 6.02 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.168 -0.469 . . . . 75.430000000000007 111.133 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 54.7 tp60 -68.51 99.22 0.94 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 75.239999999999995 110.916 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.573 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -76.58 160.19 77.74 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.697 . . . . 74.530000000000001 111.07 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.573 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.74 74.5 1.27 Allowed 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.696 2.264 . . . . 65.239999999999995 112.369 179.987 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 4.7 t -177.68 138.88 0.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.201 -0.454 . . . . 64.120000000000005 111.157 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.73 26.14 4.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.252 -0.431 . . . . 63.119999999999997 111.087 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.86 -35.23 3.23 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 71.530000000000001 111.13 179.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -141.08 177.15 8.26 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.201 -0.454 . . . . 74.430000000000007 110.914 -179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 80.2 mtp180 -147.76 154.01 39.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.072 -0.513 . . . . 75.25 110.847 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -89.02 145.94 25.17 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.205 -0.452 . . . . 71.329999999999998 110.936 -179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.726 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 96.3 m-85 -129.87 124.34 32.98 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 72.420000000000002 110.919 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.471 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.4 OUTLIER -102.64 105.87 16.43 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 63.039999999999999 110.906 -179.961 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.522 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.26 125.66 49.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.455 . . . . 70.219999999999999 111.161 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.547 ' O ' HD23 ' A' ' 529' ' ' LEU . 6.0 ttmm -104.63 107.18 18.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.144 -0.48 . . . . 74.430000000000007 110.895 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.625 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.1 mt -132.3 154.54 81.64 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 73.040000000000006 110.897 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 162.08 43.48 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.686 2.257 . . . . 71.200000000000003 112.315 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 104.36 1.31 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.669 2.246 . . . . 44.409999999999997 112.338 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.0 mt -105.32 -171.07 1.85 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.206 -0.452 . . . . 70.140000000000001 110.944 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 9.3 t -72.35 153.12 41.65 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 73.519999999999996 110.883 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -52.08 -44.46 64.36 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 70.430000000000007 110.88 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -60.48 -38.97 85.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.246 -0.434 . . . . 65.200000000000003 110.933 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 3.2 mmp_? -66.05 -53.22 41.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 73.400000000000006 110.856 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 63.5 mtm180 -55.52 -45.54 77.1 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.212 -0.449 . . . . 61.140000000000001 110.868 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mt -69.06 -38.88 79.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.193 -0.458 . . . . 64.019999999999996 110.957 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 27.5 mt-10 -63.75 -47.03 82.65 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.177 -0.465 . . . . 54.030000000000001 110.908 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.505 HD22 ' CD2' ' A' ' 505' ' ' PHE . 26.1 tp -66.1 -51.14 60.85 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 71.299999999999997 110.945 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 17.6 mt-10 -58.23 -49.78 75.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.201 -0.454 . . . . 75.200000000000003 110.913 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 8.3 mmt85 -58.39 -53.5 57.64 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.121 -0.49 . . . . 71.219999999999999 110.881 -179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 10.3 mt -52.7 -43.72 65.83 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.215 -0.448 . . . . 64.200000000000003 110.895 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.3 -56.48 21.03 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.152 -0.476 . . . . 73.219999999999999 110.889 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.46 -13.31 60.63 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.178 -0.465 . . . . 61.140000000000001 111.115 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 22.5 t -79.51 -56.97 3.93 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.169 -0.469 . . . . 74.239999999999995 110.894 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 18.4 mm-40 -88.38 -52.18 5.34 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.16 -0.473 . . . . 72.230000000000004 110.902 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 1.3 tp -67.86 -12.37 60.52 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.161 -0.472 . . . . 74.129999999999995 110.909 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER 57.63 23.38 9.3 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.22 -0.445 . . . . 65.319999999999993 110.852 179.806 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -65.08 179.84 0.65 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.425 . . . . 74.200000000000003 111.114 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 19.4 m -145.13 110.94 5.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.226 -0.443 . . . . 75.420000000000002 111.142 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.4 t -59.01 108.93 0.37 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 72.329999999999998 111.135 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 63.8 mt -89.71 -42.23 11.45 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.149 -0.478 . . . . 64.530000000000001 110.898 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -158.55 175.08 14.11 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 75.129999999999995 111.112 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 95.2 p -171.98 145.87 1.91 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.238 -0.437 . . . . 71.430000000000007 110.869 -179.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.671 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 10.6 pt-20 -137.98 147.47 44.27 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.175 -0.466 . . . . 74.099999999999994 110.861 -179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . 0.46 HG23 ' OG1' ' A' ' 481' ' ' THR . 32.2 m -139.43 142.37 37.45 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.146 -0.479 . . . . 64.239999999999995 111.095 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 23.3 t -105.85 100.84 11.43 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 63.340000000000003 111.162 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 C-N-CA 120.729 -0.748 . . . . 74.0 112.514 179.997 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 11.6 ttt . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.856 0.36 . . . . 61.119999999999997 110.877 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 60.0 t -90.07 -57.31 4.35 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.19 -0.459 . . . . 72.239999999999995 111.108 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 176.4 169.59 38.02 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.707 -0.758 . . . . 72.010000000000005 112.473 -179.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -106.98 -179.77 4.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.857 0.36 . . . . 71.030000000000001 110.884 -179.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 79.0 m-20 -133.45 145.95 50.7 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.142 -0.481 . . . . 74.200000000000003 110.899 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -121.15 27.09 8.6 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 74.150000000000006 110.884 -179.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 1.4 t -95.0 177.24 5.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.476 . . . . 62.200000000000003 110.851 -179.866 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 24.2 pt -70.17 178.45 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.124 -0.489 . . . . 64.030000000000001 111.127 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 34.1 t70 -125.47 79.7 1.83 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.169 -0.469 . . . . 73.430000000000007 110.878 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -172.24 139.56 1.06 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.185 -0.461 . . . . 74.349999999999994 110.848 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 4.6 m -95.59 144.6 25.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.153 -0.476 . . . . 73.140000000000001 111.135 -179.927 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -155.93 -115.81 0.52 Allowed Glycine 0 N--CA 1.452 -0.274 0 C-N-CA 120.75 -0.738 . . . . 52.530000000000001 112.516 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 156.01 145.22 4.13 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.7 -0.762 . . . . 41.119999999999997 112.446 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 21.2 m -124.86 107.5 10.96 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.794 0.33 . . . . 62.119999999999997 111.161 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.732 ' HB3' ' CG ' ' A' ' 556' ' ' GLU . . . -94.98 114.09 25.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 52.25 111.083 179.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -106.1 117.38 33.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 62.200000000000003 110.965 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.474 HG23 HD22 ' A' ' 526' ' ' LEU . 0.6 OUTLIER -103.34 113.6 27.23 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 60.350000000000001 111.143 -179.941 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.494 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.9 pt? -129.14 142.38 50.9 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.218 -0.446 . . . . 74.420000000000002 110.909 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 46.7 ttp180 -90.3 130.56 36.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.225 -0.443 . . . . 74.310000000000002 110.833 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . 0.659 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -133.94 169.42 17.13 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.455 . . . . 74.129999999999995 111.127 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.0 mt-10 -60.49 160.55 17.88 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.652 0.739 . . . . 64.209999999999994 110.919 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 -20.63 34.31 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.721 2.28 . . . . 72.010000000000005 112.302 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 52.0 t30 -67.97 -43.56 78.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.23 -0.441 . . . . 73.439999999999998 110.926 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.644 HG11 HD21 ' A' ' 548' ' ' LEU . 61.4 t -64.01 133.01 29.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.147 -0.479 . . . . 73.019999999999996 111.149 179.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.4 mt-10 -124.58 176.88 6.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.172 -0.467 . . . . 64.239999999999995 110.906 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 96.4 t -53.57 -50.02 52.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.154 -0.476 . . . . 75.230000000000004 111.108 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 3.1 pm0 -52.05 -37.14 52.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 74.140000000000001 110.901 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 93.5 m -69.61 -41.83 75.18 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.137 -0.483 . . . . 64.209999999999994 111.188 -179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.64 ' CB ' HD13 ' A' ' 512' ' ' ILE . 8.0 mt -63.51 -49.83 72.0 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.235 -0.439 . . . . 75.299999999999997 110.956 179.941 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -65.87 -40.13 91.33 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.182 -0.463 . . . . 73.510000000000005 110.906 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 47.2 mtp180 -61.08 -45.48 94.57 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.182 -0.463 . . . . 74.519999999999996 110.878 -179.906 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 7.2 t80 -69.5 -39.51 77.56 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.197 -0.456 . . . . 64.219999999999999 110.891 -179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.606 HD12 HD11 ' A' ' 512' ' ' ILE . 36.7 mt -58.86 -52.71 64.58 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.143 -0.48 . . . . 64.319999999999993 110.915 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -69.19 -37.96 78.4 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.19 -0.459 . . . . 75.439999999999998 110.873 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -56.18 -47.42 78.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.163 -0.471 . . . . 71.120000000000005 110.9 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 30.1 mmtm -70.56 -22.71 62.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.172 -0.467 . . . . 71.540000000000006 110.913 179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -17.86 19.43 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 120.739 -0.744 . . . . 53.210000000000001 112.519 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.75 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.3 m-85 -61.3 160.22 25.06 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.614 0.721 . . . . 74.329999999999998 110.883 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 93.2 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.671 2.247 . . . . 74.030000000000001 112.34 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.1 -38.12 1.28 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.699 -0.762 . . . . 64.140000000000001 112.434 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 7.9 pttt -60.53 -30.74 69.94 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.776 0.322 . . . . 51.200000000000003 110.906 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 -95.52 -32.79 12.69 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-N 116.194 -0.457 . . . . 74.129999999999995 110.92 179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.606 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -57.28 170.67 0.47 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.155 -0.475 . . . . 73.329999999999998 111.114 179.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 22.0 t -126.9 111.53 26.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 64.140000000000001 111.141 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.64 HD13 ' CB ' ' A' ' 496' ' ' LEU . 72.6 mt -100.53 137.48 27.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.158 -0.474 . . . . 65.430000000000007 111.108 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -137.76 138.48 39.3 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.159 -0.473 . . . . 74.120000000000005 111.118 179.973 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 3.0 tt0 -83.96 140.48 31.89 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 53.210000000000001 110.893 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 67.6 t -131.82 100.38 4.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.192 -0.458 . . . . 72.299999999999997 111.125 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -67.53 112.1 4.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 54.109999999999999 110.915 179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.582 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -94.51 160.26 31.99 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.619 0.723 . . . . 64.25 111.091 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.582 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.78 74.52 1.29 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.672 2.248 . . . . 72.230000000000004 112.374 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.631 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.0 t -176.43 137.48 0.28 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 62.530000000000001 111.096 -179.931 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.4 25.15 4.58 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.201 -0.454 . . . . 61.119999999999997 111.087 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.99 -35.4 3.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.217 -0.447 . . . . 63.43 111.055 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.631 ' O ' HG23 ' A' ' 519' ' ' THR . 12.7 m-85 -143.16 170.89 14.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 71.439999999999998 110.874 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 60.5 mtt-85 -142.67 160.32 40.54 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.08 -0.509 . . . . 74.040000000000006 110.869 -179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -91.29 141.99 28.19 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.171 -0.468 . . . . 73.099999999999994 110.887 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.659 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 80.7 m-85 -127.86 120.31 27.49 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.172 -0.467 . . . . 71.340000000000003 110.867 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.474 HD22 HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -96.39 106.22 18.41 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 70.530000000000001 110.935 -179.97 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.546 ' CG1' HD21 ' A' ' 529' ' ' LEU . 20.0 t -100.93 118.07 47.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 64.510000000000005 111.129 179.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.524 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 0.5 OUTLIER -96.6 107.45 19.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.128 -0.487 . . . . 74.25 110.91 179.907 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.606 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.3 mt -130.33 154.38 81.47 Favored Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.563 0.696 . . . . 61.520000000000003 110.93 179.936 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 162.15 43.2 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.675 2.25 . . . . 72.040000000000006 112.327 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 117.19 4.94 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.695 2.264 . . . . 61.25 112.299 179.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 2.5 mt -118.83 -170.96 2.0 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.193 -0.458 . . . . 74.230000000000004 110.91 179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.1 t -67.23 148.16 52.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 74.200000000000003 110.844 -179.911 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -51.91 -48.02 64.37 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.146 -0.479 . . . . 71.010000000000005 110.85 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -61.95 -44.53 96.57 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 62.530000000000001 110.86 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -61.07 -54.04 49.68 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.136 -0.483 . . . . 73.120000000000005 110.903 -179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 71.6 mtp180 -54.14 -53.05 58.65 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.253 -0.431 . . . . 54.520000000000003 110.838 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -60.42 -40.0 89.45 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 70.329999999999998 110.902 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 64.3 tt0 -63.25 -48.82 76.59 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.17 -0.468 . . . . 71.120000000000005 110.88 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.75 HD22 ' CD2' ' A' ' 505' ' ' PHE . 49.1 tp -59.01 -51.04 71.78 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 62.310000000000002 110.937 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -56.37 -48.81 76.09 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.17 -0.468 . . . . 74.340000000000003 110.892 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 56.5 mtt180 -63.82 -37.93 89.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 72.120000000000005 110.833 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 4.8 tt -60.27 -50.95 71.6 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.217 -0.447 . . . . 74.409999999999997 110.921 -179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . 0.508 ' CE2' HD11 ' A' ' 540' ' ' LEU . 12.2 m-85 -63.35 -50.56 69.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.195 -0.457 . . . . 72.340000000000003 110.837 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.504 ' HA ' ' HB3' ' A' ' 550' ' ' ALA . . . -61.12 -27.49 68.42 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 70.040000000000006 111.066 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.7 t -80.71 -62.73 1.58 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.253 -0.431 . . . . 64.409999999999997 110.818 -179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -64.62 -59.44 4.28 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.147 -0.479 . . . . 54.409999999999997 110.88 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.644 HD21 HG11 ' A' ' 491' ' ' VAL . 1.7 tp -68.93 -8.58 45.71 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.138 -0.483 . . . . 74.099999999999994 110.941 -179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 65.71 22.56 11.58 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.181 -0.463 . . . . 75.420000000000002 110.901 179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . 0.504 ' HB3' ' HA ' ' A' ' 545' ' ' ALA . . . -73.84 179.6 4.18 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.225 -0.443 . . . . 50.310000000000002 111.091 179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.5 m -145.05 110.95 5.45 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.201 -0.454 . . . . 55.530000000000001 111.101 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 46.9 t -52.11 112.48 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.181 -0.463 . . . . 53.420000000000002 111.131 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 13.4 mt -88.58 -51.95 5.42 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.149 -0.478 . . . . 42.340000000000003 110.932 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.55 173.78 15.84 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.198 -0.455 . . . . 75.329999999999998 111.047 179.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 95.2 p -160.7 145.41 14.18 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 63.409999999999997 110.84 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.732 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 9.4 pt-20 -139.72 148.97 43.05 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.124 -0.489 . . . . 51.310000000000002 110.911 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 26.7 m -142.06 141.66 32.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.157 -0.474 . . . . 60.240000000000002 111.107 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 37.3 t -88.09 105.68 15.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 51.130000000000003 111.165 179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 C-N-CA 120.714 -0.755 . . . . 24.219999999999999 112.492 -179.993 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.154 0 CA-C-O 120.807 0.336 . . . . 72.329999999999998 110.864 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 36.0 m -83.2 -25.28 7.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.26 -0.427 . . . . 71.340000000000003 111.134 179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 71.72 -126.02 12.02 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.748 -0.739 . . . . 75.329999999999998 112.491 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 15.2 p90 -140.32 -179.62 6.1 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.866 0.365 . . . . 71.040000000000006 110.883 -179.896 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 20.9 m-80 -109.72 -40.71 4.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 73.519999999999996 110.862 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 53.5 p90 -159.42 146.95 17.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.203 -0.453 . . . . 74.299999999999997 110.949 -179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 1.8 t -136.18 159.59 41.26 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.102 -0.499 . . . . 63.409999999999997 110.828 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 66.1 mt -103.12 140.9 20.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.1 -0.5 . . . . 64.340000000000003 111.168 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 10.0 t0 -117.73 60.67 0.77 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.17 -0.468 . . . . 60.149999999999999 110.825 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 24.9 t80 -163.11 148.7 11.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.215 -0.448 . . . . 74.209999999999994 110.923 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -130.6 141.54 50.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.119 -0.491 . . . . 74.099999999999994 111.122 -179.886 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -139.8 -50.61 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.705 -0.76 . . . . 55.140000000000001 112.446 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 112.18 159.27 14.66 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.719 -0.753 . . . . 51.009999999999998 112.461 -179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 20.1 m -128.91 109.35 11.17 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.751 0.31 . . . . 74.409999999999997 111.139 -179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -96.0 123.98 39.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.24 -0.437 . . . . 64.0 111.111 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -115.05 111.29 20.87 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.213 -0.449 . . . . 75.549999999999997 110.921 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.81 113.97 25.65 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.109 -0.496 . . . . 45.130000000000003 111.138 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.507 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.9 pt? -130.28 143.09 50.57 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.202 -0.454 . . . . 60.340000000000003 110.924 179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.603 ' HB2' HD21 ' A' ' 553' ' ' LEU . 10.8 ttt180 -86.99 141.38 28.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.442 . . . . 72.0 110.885 179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . 0.738 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -149.47 160.64 43.28 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.186 -0.461 . . . . 64.340000000000003 111.137 179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . 0.643 ' HG2' HG23 ' A' ' 491' ' ' VAL . 1.6 pm0 -51.72 156.85 2.16 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.658 0.742 . . . . 75.329999999999998 110.894 -179.878 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.69 -9.24 25.63 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.712 2.275 . . . . 74.219999999999999 112.375 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -77.87 -44.66 26.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.206 -0.452 . . . . 71.5 110.918 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.643 HG23 ' HG2' ' A' ' 488' ' ' GLU . 97.4 t -56.34 124.29 9.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.189 -0.46 . . . . 74.519999999999996 111.153 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 31.1 mt-10 -116.67 171.41 7.89 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.152 -0.476 . . . . 70.239999999999995 110.898 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 91.5 t -51.71 -49.52 34.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.194 -0.457 . . . . 72.430000000000007 111.101 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -53.02 -40.17 63.69 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 72.430000000000007 110.932 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 89.5 m -66.91 -45.43 77.97 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 71.439999999999998 111.182 -179.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.485 ' CB ' HD13 ' A' ' 512' ' ' ILE . 8.7 mt -61.58 -51.08 70.03 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.205 -0.452 . . . . 63.229999999999997 110.923 179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . 0.488 ' HB3' HD12 ' A' ' 512' ' ' ILE . 9.4 ptm180 -63.5 -37.0 85.62 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.234 -0.439 . . . . 63.350000000000001 110.863 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 29.5 mtt85 -63.75 -44.29 93.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.143 -0.481 . . . . 73.25 110.895 -179.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.9 t80 -70.25 -36.62 74.58 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.151 -0.477 . . . . 75.400000000000006 110.895 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.525 HD12 HD11 ' A' ' 512' ' ' ILE . 38.4 mt -63.04 -53.05 59.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.118 -0.492 . . . . 61.539999999999999 110.92 -179.937 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.0 pp20? -67.97 -38.36 82.64 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.162 -0.472 . . . . 72.299999999999997 110.88 179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 20.6 tp10 -58.52 -48.56 80.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.153 -0.476 . . . . 73.299999999999997 110.914 -179.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 56.7 mmtt -65.89 -25.07 67.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.146 -0.479 . . . . 71.420000000000002 110.896 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.04 -17.88 19.38 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.754 -0.736 . . . . 43.310000000000002 112.464 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.793 ' CD2' HD22 ' A' ' 540' ' ' LEU . 18.4 m-85 -62.18 160.21 32.96 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.65 0.738 . . . . 71.430000000000007 110.891 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . 0.421 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 53.5 Cg_endo -69.75 88.29 0.54 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.691 2.261 . . . . 62.25 112.337 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -104.64 -28.36 5.71 Favored Glycine 0 N--CA 1.45 -0.372 0 C-N-CA 120.783 -0.722 . . . . 55.109999999999999 112.513 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 25.9 mtmt -64.91 -52.02 58.74 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.744 0.307 . . . . 74.299999999999997 110.949 179.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 23.3 pt-20 -75.76 -26.11 57.1 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.183 -0.462 . . . . 63.509999999999998 110.868 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.611 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -63.55 167.32 5.74 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.172 -0.467 . . . . 52.299999999999997 111.084 179.935 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.92 112.83 30.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.214 -0.448 . . . . 62.299999999999997 111.108 179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.525 HD11 HD12 ' A' ' 500' ' ' LEU . 43.6 mt -97.67 129.35 47.95 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.157 -0.474 . . . . 73.349999999999994 111.106 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -123.01 142.67 50.59 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.141 -0.481 . . . . 53.100000000000001 111.088 -179.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 19.2 pt20 -98.64 129.43 45.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.189 -0.46 . . . . 55.32 110.915 179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 84.7 t -122.88 102.69 11.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.257 -0.429 . . . . 73.540000000000006 111.151 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.17 109.13 10.78 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.209 -0.45 . . . . 64.409999999999997 110.935 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -88.46 160.31 45.25 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.584 0.707 . . . . 74.299999999999997 111.081 179.965 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.3 Cg_endo -69.76 74.48 1.29 Allowed 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.752 2.301 . . . . 75.129999999999995 112.315 -179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.503 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.6 t -176.54 137.02 0.26 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.241 -0.436 . . . . 64.310000000000002 111.154 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.68 28.64 2.93 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.244 -0.435 . . . . 53.210000000000001 111.106 179.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.22 -34.74 3.26 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 54.420000000000002 111.088 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.503 ' O ' HG23 ' A' ' 519' ' ' THR . 13.8 m-85 -149.18 169.9 19.67 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 72.549999999999997 110.969 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 44.9 mtp180 -143.63 162.3 36.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.145 -0.479 . . . . 63.219999999999999 110.853 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -96.1 141.24 29.73 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.147 -0.479 . . . . 71.530000000000001 110.883 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.738 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 89.5 m-85 -128.54 124.31 35.67 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.154 -0.475 . . . . 71.5 110.878 -179.924 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.404 HD22 ' HA ' ' A' ' 526' ' ' LEU . 0.5 OUTLIER -99.53 110.01 22.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.136 -0.484 . . . . 72.150000000000006 110.943 179.998 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.536 HG12 HD21 ' A' ' 529' ' ' LEU . 21.5 t -101.71 116.73 45.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.459 . . . . 75.530000000000001 111.107 179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.544 ' O ' HD23 ' A' ' 529' ' ' LEU . 26.1 tttt -96.5 108.25 20.79 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.183 -0.462 . . . . 71.019999999999996 110.881 179.894 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.611 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.5 mt -132.7 154.45 81.48 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.611 0.72 . . . . 75.530000000000001 110.903 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 162.09 43.43 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.726 2.284 . . . . 74.299999999999997 112.327 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 112.93 3.21 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.697 2.264 . . . . 63.439999999999998 112.302 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.5 mt -114.89 -172.68 2.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 62.32 110.921 179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 31.6 m -64.32 149.34 48.36 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.182 -0.463 . . . . 62.109999999999999 110.88 -179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -51.94 -50.83 60.41 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.144 -0.48 . . . . 72.329999999999998 110.871 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 63.2 mm-40 -62.54 -37.19 85.16 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.216 -0.447 . . . . 74.230000000000004 110.853 -179.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -64.49 -53.88 41.15 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.199 -0.455 . . . . 71.439999999999998 110.865 -179.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 74.3 mtm180 -57.9 -51.11 70.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 74.519999999999996 110.82 -179.905 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.0 mt -60.7 -41.07 94.45 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.224 -0.444 . . . . 71.230000000000004 110.943 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -61.91 -47.36 85.31 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.2 -0.455 . . . . 64.349999999999994 110.884 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.793 HD22 ' CD2' ' A' ' 505' ' ' PHE . 29.6 tp -61.24 -51.1 70.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.188 -0.46 . . . . 71.230000000000004 110.961 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 21.2 mt-10 -55.52 -45.26 77.14 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.15 -0.477 . . . . 74.230000000000004 110.912 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 11.8 mtp85 -68.15 -38.68 82.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 71.510000000000005 110.902 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . 0.533 HD23 ' O ' ' A' ' 543' ' ' LEU . 4.9 tt -60.52 -41.94 95.43 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.17 -0.468 . . . . 44.32 110.93 -179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . 0.504 ' CE2' HD11 ' A' ' 540' ' ' LEU . 9.8 m-85 -72.16 -50.64 26.18 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 71.209999999999994 110.832 179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . 0.471 ' HA ' ' HB3' ' A' ' 550' ' ' ALA . . . -61.47 -26.36 67.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 60.509999999999998 111.142 179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 67.5 p -80.72 -62.67 1.6 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 71.340000000000003 110.908 -179.829 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -65.98 -58.95 4.37 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.113 -0.494 . . . . 74.209999999999994 110.891 -179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.508 HD21 HG11 ' A' ' 491' ' ' VAL . 1.8 tp -68.92 -8.53 45.16 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.158 -0.473 . . . . 65.319999999999993 110.93 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt 64.61 22.84 12.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.142 -0.481 . . . . 62.43 110.883 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . 0.471 ' HB3' ' HA ' ' A' ' 545' ' ' ALA . . . -72.32 178.46 3.93 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.224 -0.444 . . . . 65.099999999999994 111.077 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 63.3 m -145.03 110.91 5.44 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.205 -0.452 . . . . 72.209999999999994 111.111 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.2 t -52.15 123.63 3.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.232 -0.44 . . . . 74.150000000000006 111.156 179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . 0.603 HD21 ' HB2' ' A' ' 486' ' ' ARG . 18.4 mt -103.78 -49.64 3.61 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.207 -0.452 . . . . 73.299999999999997 110.942 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -151.26 172.67 15.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.168 -0.469 . . . . 63.439999999999998 111.082 179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 89.3 p -163.35 155.23 17.57 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 61.409999999999997 110.886 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 12.6 mm-40 -141.13 140.78 34.18 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.127 -0.488 . . . . 71.439999999999998 110.913 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 14.0 m -143.05 145.74 33.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.156 -0.475 . . . . 74.209999999999994 111.092 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 42.4 t -109.79 114.05 45.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.163 -0.471 . . . . 65.310000000000002 111.114 179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.331 0 C-N-CA 120.723 -0.751 . . . . 73.239999999999995 112.437 -180.0 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 16.1 mtm . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.828 0.347 . . . . 72.129999999999995 110.883 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 33.2 m -143.2 155.03 16.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.264 -0.425 . . . . 75.030000000000001 111.089 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 148.89 -127.57 2.55 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.727 -0.749 . . . . 73.140000000000001 112.498 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 45.9 p90 -168.76 167.16 11.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.85 0.357 . . . . 52.109999999999999 110.871 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -120.56 82.15 1.87 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.125 -0.489 . . . . 63.140000000000001 110.908 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -116.46 125.4 51.93 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 63.119999999999997 110.908 -179.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 4.5 m 55.9 37.22 28.61 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 72.219999999999999 110.809 -179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 33.6 pt -60.5 -178.2 0.08 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.152 -0.476 . . . . 72.040000000000006 111.174 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -105.73 -21.43 13.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.244 -0.434 . . . . 73.409999999999997 110.884 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 86.7 m-85 -105.53 78.67 1.38 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 72.129999999999995 110.95 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 2.8 m -103.0 157.0 17.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.143 -0.481 . . . . 74.439999999999998 111.123 -179.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -142.64 -113.42 0.95 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.699 -0.762 . . . . 64.239999999999995 112.481 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -178.19 157.68 21.91 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.758 -0.734 . . . . 63.109999999999999 112.518 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . 0.626 ' OG1' HG23 ' A' ' 557' ' ' THR . 34.0 m -131.5 110.71 11.18 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.76 0.314 . . . . 75.019999999999996 111.117 -179.848 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.48 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -96.59 119.73 35.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.209 -0.45 . . . . 60.140000000000001 111.147 179.808 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -110.43 113.77 26.68 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.995 0.426 . . . . 65.150000000000006 110.916 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.495 HG23 HD22 ' A' ' 526' ' ' LEU . 1.3 m -97.89 112.31 24.28 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.099 -0.501 . . . . 74.239999999999995 111.098 -179.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.453 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.7 pt? -134.19 142.39 47.39 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.176 -0.465 . . . . 73.239999999999995 110.917 179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 27.6 mtp180 -88.85 141.5 28.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.224 -0.444 . . . . 72.129999999999995 110.892 179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . 0.697 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -140.4 160.95 38.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.177 -0.465 . . . . 72.329999999999998 111.102 179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . 0.63 ' HG3' HG23 ' A' ' 491' ' ' VAL . 7.0 pt-20 -51.76 156.9 2.16 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.613 0.721 . . . . 74.109999999999999 110.89 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -9.14 25.37 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.686 2.257 . . . . 64.209999999999994 112.326 -179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 31.2 t30 -80.7 -43.08 20.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.216 -0.447 . . . . 73.219999999999999 110.82 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.63 HG23 ' HG3' ' A' ' 488' ' ' GLU . 72.1 t -65.69 134.19 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.227 -0.442 . . . . 75.010000000000005 111.116 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -125.81 175.88 7.33 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.209 -0.45 . . . . 61.109999999999999 110.903 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 60.6 t -51.65 -49.91 32.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 74.219999999999999 111.113 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 9.6 pt-20 -51.93 -41.46 62.04 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.151 -0.477 . . . . 63.210000000000001 110.899 -179.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 88.4 m -67.91 -37.96 82.33 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.113 -0.494 . . . . 74.140000000000001 111.147 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.624 ' HB3' HD13 ' A' ' 512' ' ' ILE . 3.9 mt -64.94 -50.95 64.42 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.21 -0.45 . . . . 63.119999999999997 110.942 179.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 17.9 ptt85 -63.86 -42.94 97.43 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 62.310000000000002 110.855 179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -61.66 -41.73 97.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.218 -0.447 . . . . 73.420000000000002 110.862 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 9.0 t80 -69.46 -40.39 77.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.197 -0.456 . . . . 53.020000000000003 110.906 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 32.6 mt -60.92 -51.77 67.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.156 -0.474 . . . . 72.540000000000006 110.936 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -67.87 -38.34 82.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 73.420000000000002 110.895 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -57.92 -48.84 78.72 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.155 -0.475 . . . . 61.210000000000001 110.901 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.1 mmtt -67.67 -24.9 65.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.139 -0.482 . . . . 74.319999999999993 110.866 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -18.46 18.92 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.704 -0.76 . . . . 71.209999999999994 112.48 179.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.427 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.5 m-85 -65.35 160.27 59.96 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.705 0.765 . . . . 75.409999999999997 110.838 -179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.79 95.6 0.56 Allowed 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.682 2.255 . . . . 64.25 112.334 -179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -112.3 -51.97 0.53 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.717 -0.754 . . . . 63.539999999999999 112.454 -179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 16.4 mmmt -52.04 -51.56 56.66 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.713 0.292 . . . . 72.430000000000007 110.86 -179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -68.74 -27.39 65.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.248 -0.433 . . . . 74.120000000000005 110.846 179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.599 ' HB1' ' O ' ' A' ' 528' ' ' LYS . . . -68.61 175.26 3.59 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.189 -0.459 . . . . 74.0 111.083 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.02 111.11 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.466 . . . . 71.319999999999993 111.151 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.624 HD13 ' HB3' ' A' ' 496' ' ' LEU . 69.5 mt -97.45 140.92 16.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.159 -0.473 . . . . 75.409999999999997 111.119 179.95 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.5 m -136.16 147.46 47.73 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 62.329999999999998 111.175 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.6 pt20 -98.72 143.62 28.87 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.221 -0.445 . . . . 74.129999999999995 110.933 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 60.0 t -139.0 111.01 5.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.182 -0.463 . . . . 72.530000000000001 111.122 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -77.66 113.42 15.49 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.182 -0.463 . . . . 75.299999999999997 110.897 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.589 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -95.06 160.27 31.25 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.571 0.7 . . . . 73.540000000000006 111.099 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.589 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.4 Cg_endo -69.74 74.56 1.27 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.707 2.271 . . . . 63.340000000000003 112.316 179.99 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.583 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.9 t -176.59 139.24 0.31 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 62.439999999999998 111.093 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.5 27.27 4.88 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 72.209999999999994 111.098 179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.5 -34.94 3.17 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.205 -0.452 . . . . 53.32 111.12 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.583 ' O ' HG23 ' A' ' 519' ' ' THR . 12.5 m-85 -146.03 162.63 37.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.241 -0.436 . . . . 74.140000000000001 110.945 -179.88 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 71.3 mtt-85 -130.37 160.93 32.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.095 -0.502 . . . . 72.019999999999996 110.904 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 63.7 tt0 -94.23 139.76 30.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.191 -0.459 . . . . 63.119999999999997 110.905 -179.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.697 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 89.6 m-85 -127.85 124.64 38.02 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.14 -0.482 . . . . 74.519999999999996 110.905 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.495 HD22 HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -101.09 103.58 14.67 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.164 -0.471 . . . . 64.310000000000002 110.966 -179.98 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.548 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.5 t -96.82 127.94 48.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.196 -0.457 . . . . 73.230000000000004 111.142 179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.599 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 41.6 tttt -106.91 109.0 20.79 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.173 -0.467 . . . . 75.549999999999997 110.871 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.594 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.5 mt -130.6 154.39 81.7 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.587 0.708 . . . . 74.549999999999997 110.921 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 162.14 43.2 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.654 2.236 . . . . 72.239999999999995 112.31 179.865 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 109.63 2.37 Favored 'Trans proline' 0 C--O 1.232 0.201 0 C-N-CA 122.697 2.264 . . . . 74.519999999999996 112.31 179.968 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.7 mt -111.54 -172.35 2.02 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.229 -0.441 . . . . 75.5 110.943 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -70.66 153.67 42.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.237 -0.438 . . . . 63.299999999999997 110.827 -179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -52.1 -46.35 65.24 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.131 -0.486 . . . . 74.25 110.826 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -60.34 -36.0 76.95 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.239 -0.437 . . . . 74.219999999999999 110.877 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -66.36 -56.62 10.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 74.109999999999999 110.861 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 62.0 mtm180 -54.93 -44.84 74.63 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.187 -0.461 . . . . 74.140000000000001 110.878 -179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.51 HD22 ' NE ' ' A' ' 542' ' ' ARG . 2.3 mt -67.9 -41.04 83.3 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.18 -0.464 . . . . 74.049999999999997 110.92 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -63.17 -46.83 85.31 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.21 -0.45 . . . . 75.530000000000001 110.919 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.427 HD22 ' CD2' ' A' ' 505' ' ' PHE . 23.9 tp -64.95 -51.15 63.39 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.153 -0.476 . . . . 71.420000000000002 110.931 179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -58.47 -50.25 74.4 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.143 -0.481 . . . . 75.219999999999999 110.902 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . 0.51 ' NE ' HD22 ' A' ' 538' ' ' LEU . 96.8 mtt180 -58.45 -53.25 60.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 62.420000000000002 110.878 -179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . 0.48 HD23 ' O ' ' A' ' 543' ' ' LEU . 5.7 tt -52.76 -43.48 65.81 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.196 -0.456 . . . . 74.109999999999999 110.897 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.8 m-85 -60.68 -56.47 20.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.198 -0.456 . . . . 74.150000000000006 110.915 179.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.32 -13.34 60.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 75.299999999999997 111.121 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.65 -57.27 3.76 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.198 -0.455 . . . . 63.310000000000002 110.85 -179.78 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 25.7 mm-40 -88.36 -52.29 5.28 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.113 -0.494 . . . . 70.340000000000003 110.831 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -67.77 -12.37 60.43 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.136 -0.484 . . . . 72.209999999999994 110.916 -179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 2.8 mtpp 57.25 23.53 8.85 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.229 -0.441 . . . . 74.450000000000003 110.924 179.861 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.36 174.21 2.82 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.237 -0.438 . . . . 54.340000000000003 111.079 179.867 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 92.4 m -135.49 110.96 9.13 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.215 -0.448 . . . . 61.5 111.114 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.7 t -58.22 108.34 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 44.130000000000003 111.133 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 10.3 mt -84.49 -49.2 8.84 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.169 -0.469 . . . . 74.540000000000006 110.963 179.913 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -159.03 173.8 15.92 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.468 . . . . 73.230000000000004 111.144 179.764 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 93.8 p -165.57 139.32 4.56 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.259 -0.428 . . . . 62.420000000000002 110.848 -179.786 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.48 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 1.2 pm0 -134.73 145.49 48.51 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.13 -0.486 . . . . 72.200000000000003 110.877 -179.923 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . 0.626 HG23 ' OG1' ' A' ' 481' ' ' THR . 6.1 m -139.1 138.73 37.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.17 -0.468 . . . . 65.310000000000002 111.143 -179.888 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 41.7 t -86.13 106.04 15.17 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.179 -0.464 . . . . 54.140000000000001 111.132 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.3 0 C-N-CA 120.723 -0.751 . . . . 45.039999999999999 112.491 179.982 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.144 0 CA-C-O 120.8 0.333 . . . . 74.299999999999997 110.899 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 14.4 p -166.01 149.54 1.89 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.255 -0.429 . . . . 45.009999999999998 111.095 179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -91.26 -104.77 1.36 Allowed Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.745 -0.741 . . . . 73.129999999999995 112.504 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 75.1 t80 -144.7 116.12 8.06 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.869 0.366 . . . . 73.310000000000002 110.878 -179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 11.7 p-10 -153.31 133.49 13.41 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 70.25 110.89 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 24.5 p90 -116.27 126.62 53.82 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.175 -0.466 . . . . 63.340000000000003 110.916 -179.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 14.4 m -151.2 122.74 7.93 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.1 -0.5 . . . . 62.049999999999997 110.83 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 34.9 pt -113.14 148.2 16.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 111.134 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -159.95 113.19 2.16 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.163 -0.471 . . . . 75.120000000000005 110.894 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 51.8 m-85 -108.94 -71.61 0.76 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 73.329999999999998 110.866 -179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 95.2 m -154.47 126.05 7.51 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.122 -0.49 . . . . 74.329999999999998 111.133 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 178.18 -94.18 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.772 -0.728 . . . . 61.450000000000003 112.465 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 106.63 150.35 17.5 Favored Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.72 -0.752 . . . . 71.25 112.487 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 2.7 m -125.29 107.51 10.78 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.743 0.306 . . . . 51.530000000000001 111.128 -179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.0 116.58 28.88 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.253 -0.43 . . . . 52.409999999999997 111.107 179.83 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 13.2 m-85 -105.95 114.21 28.21 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.205 -0.452 . . . . 74.209999999999994 110.909 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.493 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.9 OUTLIER -98.54 113.89 26.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.134 -0.485 . . . . 74.219999999999999 111.108 -179.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.492 HD23 ' H ' ' A' ' 485' ' ' LEU . 2.0 pt? -133.15 147.02 52.08 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.216 -0.447 . . . . 72.400000000000006 110.943 179.923 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.92 147.12 23.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.222 -0.444 . . . . 74.310000000000002 110.855 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . 0.679 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -156.73 165.81 35.16 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.171 -0.468 . . . . 75.540000000000006 111.069 179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 -53.64 153.52 7.83 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.65 0.738 . . . . 61.130000000000003 110.9 -179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.7 -12.32 32.77 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.692 2.261 . . . . 74.430000000000007 112.326 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -74.24 -38.34 63.54 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.234 -0.439 . . . . 71.219999999999999 110.886 -179.973 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 93.6 t -65.85 124.47 20.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 71.430000000000007 111.114 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -114.97 174.65 5.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.168 -0.469 . . . . 73.219999999999999 110.894 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.447 HG13 ' HB ' ' A' ' 512' ' ' ILE . 96.2 t -52.05 -45.77 41.79 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.173 -0.467 . . . . 65.329999999999998 111.151 179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 56.0 mt-10 -54.42 -40.22 68.07 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.153 -0.476 . . . . 61.439999999999998 110.909 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 85.5 m -67.04 -44.17 80.89 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.131 -0.486 . . . . 73.120000000000005 111.179 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.547 ' CB ' HD13 ' A' ' 512' ' ' ILE . 5.1 mt -62.22 -51.04 69.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.242 -0.435 . . . . 74.530000000000001 110.911 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . 0.447 ' HB3' HD12 ' A' ' 512' ' ' ILE . 26.5 ptt180 -64.35 -35.95 82.55 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.195 -0.457 . . . . 75.340000000000003 110.869 179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 51.2 mtp180 -63.92 -46.05 86.51 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.231 -0.441 . . . . 74.230000000000004 110.894 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -69.99 -36.11 74.92 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.189 -0.459 . . . . 75.219999999999999 110.925 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.603 HD12 HD11 ' A' ' 512' ' ' ILE . 35.7 mt -62.66 -52.78 61.99 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.474 . . . . 72.040000000000006 110.912 179.977 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -68.62 -38.04 80.23 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.205 -0.452 . . . . 75.329999999999998 110.925 179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -58.7 -48.02 82.54 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.162 -0.472 . . . . 72.150000000000006 110.878 -179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -67.38 -24.33 65.68 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 75.129999999999995 110.908 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.01 -18.86 18.6 Favored Glycine 0 N--CA 1.45 -0.371 0 C-N-CA 120.738 -0.744 . . . . 70.150000000000006 112.513 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.671 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.1 m-85 -62.57 160.3 35.77 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.673 0.749 . . . . 71.430000000000007 110.896 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.7 93.18 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.747 2.298 . . . . 72.239999999999995 112.348 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -106.96 -41.03 1.74 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.733 -0.746 . . . . 73.519999999999996 112.513 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 27.0 mtpp -58.75 -51.67 68.98 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.755 0.312 . . . . 75.540000000000006 110.94 179.99 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.86 -31.19 67.79 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.233 -0.439 . . . . 70.430000000000007 110.932 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.635 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -63.64 169.91 3.62 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.128 -0.487 . . . . 54.140000000000001 111.065 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.96 111.27 25.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 72.239999999999995 111.151 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.603 HD11 HD12 ' A' ' 500' ' ' LEU . 73.4 mt -96.87 136.35 27.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.348 0 CA-C-N 116.2 -0.455 . . . . 72.019999999999996 111.131 179.921 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.6 m -137.44 140.58 41.36 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 73.340000000000003 111.109 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -91.98 143.0 26.92 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.224 -0.443 . . . . 72.430000000000007 110.885 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 99.0 t -133.74 125.65 49.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.201 -0.454 . . . . 64.420000000000002 111.143 179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -79.97 126.29 30.84 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 54.240000000000002 110.951 179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.586 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -109.53 160.2 28.69 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.564 0.697 . . . . 71.310000000000002 111.112 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.586 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.6 Cg_endo -69.81 74.6 1.3 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.637 2.224 . . . . 72.450000000000003 112.35 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.504 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.9 t -179.91 137.11 0.12 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 54.109999999999999 111.123 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.6 24.49 5.21 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 74.400000000000006 111.114 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.03 -35.31 3.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.233 -0.439 . . . . 44.310000000000002 111.106 179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.504 ' O ' HG23 ' A' ' 519' ' ' THR . 7.7 m-85 -135.38 167.22 21.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.205 -0.452 . . . . 63.25 110.914 -179.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 7.8 mmm-85 -137.26 162.2 34.14 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.154 -0.476 . . . . 71.409999999999997 110.886 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -95.47 144.84 25.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.193 -0.458 . . . . 74.019999999999996 110.909 -179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.679 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 92.6 m-85 -131.52 122.29 25.9 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.164 -0.471 . . . . 74.450000000000003 110.898 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.493 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.4 OUTLIER -103.11 103.57 13.65 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.161 -0.472 . . . . 73.030000000000001 110.899 -179.965 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.533 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.5 t -96.59 128.36 47.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.142 -0.481 . . . . 74.510000000000005 111.142 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.538 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 38.4 tttm -104.65 108.55 20.07 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.146 -0.479 . . . . 64.439999999999998 110.873 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.635 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.9 mt -130.92 154.36 81.95 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.624 0.726 . . . . 61.539999999999999 110.924 179.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 162.09 43.41 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.697 2.265 . . . . 73.329999999999998 112.338 179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.73 105.21 1.44 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.67 2.247 . . . . 75.519999999999996 112.321 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -105.04 -171.1 1.86 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 63.049999999999997 110.943 179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 43.2 t -73.53 151.04 41.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.161 -0.472 . . . . 73.239999999999995 110.847 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -52.0 -50.02 62.18 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.081 -0.509 . . . . 64.340000000000003 110.912 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 35.5 mm-40 -58.3 -49.26 77.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.166 -0.47 . . . . 70.0 110.893 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 14.9 mmp_? -56.45 -56.78 16.91 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.162 -0.472 . . . . 61.530000000000001 110.902 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 26.1 mtp180 -53.35 -46.51 69.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.14 -0.482 . . . . 72.329999999999998 110.863 -179.89 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.1 mt -61.44 -37.67 84.4 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.218 -0.446 . . . . 72.430000000000007 110.945 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -66.3 -44.28 83.9 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.172 -0.467 . . . . 74.209999999999994 110.897 179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.671 HD22 ' CD2' ' A' ' 505' ' ' PHE . 21.5 tp -63.04 -51.16 67.8 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.14 -0.482 . . . . 75.340000000000003 110.96 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -58.47 -49.55 76.93 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.196 -0.457 . . . . 70.129999999999995 110.873 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 60.8 mtt-85 -58.48 -53.03 62.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.153 -0.476 . . . . 73.329999999999998 110.876 -179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . 0.462 HD23 ' O ' ' A' ' 543' ' ' LEU . 5.0 tt -52.71 -44.8 66.59 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.171 -0.468 . . . . 74.329999999999998 110.917 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.6 m-85 -59.67 -56.39 22.41 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.165 -0.47 . . . . 63.149999999999999 110.871 179.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.3 -13.29 60.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.165 -0.471 . . . . 31.120000000000001 111.092 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 16.8 t -79.51 -57.26 3.78 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.202 -0.454 . . . . 74.420000000000002 110.849 -179.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -88.37 -52.16 5.35 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.153 -0.476 . . . . 73.439999999999998 110.89 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.447 HD23 ' HB2' ' A' ' 550' ' ' ALA . 1.3 tp -67.83 -12.47 60.69 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.165 -0.47 . . . . 75.420000000000002 110.927 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 32.9 mmtm 57.62 23.11 8.96 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 75.540000000000006 110.87 179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . 0.447 ' HB2' HD23 ' A' ' 548' ' ' LEU . . . -66.18 -179.66 0.8 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.217 -0.447 . . . . 34.539999999999999 111.09 179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 27.8 m -141.71 110.94 6.34 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 72.120000000000005 111.191 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.12 107.61 0.3 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.235 -0.439 . . . . 74.349999999999994 111.137 179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 11.7 mt -83.28 -49.92 8.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 75.319999999999993 110.942 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.46 174.92 11.28 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.203 -0.453 . . . . 72.340000000000003 111.057 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 82.7 p -156.98 154.91 30.41 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 74.540000000000006 110.848 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -128.77 143.14 50.85 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 116.11 -0.496 . . . . 55.409999999999997 110.895 -179.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 7.3 m -141.1 144.49 34.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 64.219999999999999 111.132 -179.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 22.7 t -112.29 112.57 41.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 65.450000000000003 111.108 179.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 C-N-CA 120.768 -0.73 . . . . 73.439999999999998 112.494 179.953 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 57.1 mmm . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.827 0.346 . . . . 73.239999999999995 110.914 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 22.5 m -147.08 130.38 8.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 71.310000000000002 111.152 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -154.24 105.48 0.27 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.767 -0.73 . . . . 51.020000000000003 112.51 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -90.47 61.84 5.08 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.912 0.387 . . . . 71.120000000000005 110.891 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -170.09 134.99 1.3 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 64.25 110.906 -179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -141.89 120.21 12.3 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.176 -0.465 . . . . 72.040000000000006 110.941 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 25.6 p -130.31 169.12 15.85 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.132 -0.486 . . . . 74.439999999999998 110.888 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 66.7 mt -123.69 140.27 47.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 116.194 -0.457 . . . . 74.349999999999994 111.123 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -160.55 114.33 2.11 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.167 -0.469 . . . . 75.439999999999998 110.871 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 90.2 t80 -123.52 -55.37 1.74 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.211 -0.45 . . . . 74.239999999999995 110.846 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 14.8 t -128.37 171.91 11.59 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.165 -0.47 . . . . 74.519999999999996 111.184 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 109.46 117.36 3.95 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.731 -0.747 . . . . 72.530000000000001 112.532 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -129.92 149.15 18.73 Favored Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.739 -0.743 . . . . 73.230000000000004 112.455 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . 0.45 HG23 ' OG1' ' A' ' 557' ' ' THR . 16.0 m -126.77 109.01 11.57 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.811 0.339 . . . . 75.420000000000002 111.153 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.688 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -95.53 130.14 42.48 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.2 -0.454 . . . . 72.329999999999998 111.08 179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 9.4 m-85 -119.34 113.6 21.07 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.203 -0.453 . . . . 65.439999999999998 110.953 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.464 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.9 OUTLIER -96.78 110.98 23.34 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 64.299999999999997 111.126 -179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.489 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -132.51 143.51 49.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 72.109999999999999 110.957 179.902 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 40.5 ttp180 -91.05 142.82 27.35 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 73.420000000000002 110.878 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . 0.519 ' HB3' ' CE1' ' A' ' 525' ' ' PHE . . . -144.58 170.9 15.17 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.181 -0.463 . . . . 71.239999999999995 111.103 179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -63.28 160.54 40.06 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.607 0.718 . . . . 73.140000000000001 110.908 -179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 -14.53 36.25 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.683 2.255 . . . . 72.319999999999993 112.334 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.6 m120 -73.22 -44.99 58.65 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.215 -0.448 . . . . 61.310000000000002 110.849 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.541 HG11 HD21 ' A' ' 548' ' ' LEU . 98.5 t -64.06 138.45 23.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.174 -0.466 . . . . 71.510000000000005 111.13 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 8.7 mt-10 -136.27 178.98 6.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.145 -0.48 . . . . 71.430000000000007 110.882 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.463 HG13 ' HB ' ' A' ' 512' ' ' ILE . 48.5 t -51.74 -48.63 37.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.142 -0.481 . . . . 60.539999999999999 111.121 179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 60.7 tt0 -51.7 -39.91 59.19 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.192 -0.458 . . . . 65.120000000000005 110.852 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.0 m -71.55 -35.42 70.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.203 -0.453 . . . . 72.510000000000005 111.195 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.598 ' CB ' HD13 ' A' ' 512' ' ' ILE . 4.9 mt -67.38 -44.71 78.25 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.188 -0.46 . . . . 73.25 110.888 179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -69.97 -46.03 66.11 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.183 -0.462 . . . . 71.310000000000002 110.876 179.952 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.8 ptm180 -64.61 -32.7 74.47 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 53.329999999999998 110.895 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.0 t80 -73.8 -45.11 53.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.2 -0.455 . . . . 71.099999999999994 110.867 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.412 HD23 HD11 ' A' ' 540' ' ' LEU . 50.3 mt -62.58 -42.45 99.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.13 -0.486 . . . . 74.230000000000004 110.92 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -73.17 -37.79 66.42 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 73.349999999999994 110.896 179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -61.45 -47.47 85.57 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.154 -0.475 . . . . 73.5 110.882 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -69.14 -24.29 64.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.164 -0.471 . . . . 73.109999999999999 110.913 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.05 -16.75 20.24 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.77 -0.729 . . . . 54.43 112.453 179.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.411 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.6 m-85 -68.07 160.25 75.58 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.646 0.736 . . . . 72.230000000000004 110.834 -179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 97.25 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.649 2.233 . . . . 61.439999999999998 112.363 179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -109.83 -44.9 1.0 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.734 -0.746 . . . . 74.430000000000007 112.513 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -60.2 -52.0 67.19 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.757 0.313 . . . . 74.150000000000006 110.946 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -66.71 -33.4 75.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.178 -0.465 . . . . 74.549999999999997 110.907 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.622 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -63.78 175.4 1.14 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 71.010000000000005 111.096 179.921 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -127.04 116.35 44.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.218 -0.446 . . . . 74.209999999999994 111.137 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.598 HD13 ' CB ' ' A' ' 496' ' ' LEU . 64.1 mt -96.2 143.0 12.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.18 -0.464 . . . . 73.340000000000003 111.114 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -139.94 135.55 32.92 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.163 -0.472 . . . . 73.340000000000003 111.167 179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -94.89 143.98 26.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.242 -0.436 . . . . 72.310000000000002 110.888 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 82.7 t -138.62 106.16 3.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.199 -0.455 . . . . 61.530000000000001 111.17 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -72.79 101.38 3.11 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.157 -0.474 . . . . 65.120000000000005 110.907 -179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.564 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -79.96 160.23 69.22 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.589 0.709 . . . . 33.32 111.105 179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.564 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.3 Cg_endo -69.71 74.54 1.26 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.703 2.269 . . . . 74.230000000000004 112.377 179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.602 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.9 t -176.38 139.56 0.35 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.211 -0.449 . . . . 71.219999999999999 111.162 -179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -97.35 26.01 5.19 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.252 -0.431 . . . . 72.310000000000002 111.144 179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.63 -35.06 3.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 74.420000000000002 111.143 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.602 ' O ' HG23 ' A' ' 519' ' ' THR . 16.6 m-85 -144.12 165.22 28.42 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.156 -0.474 . . . . 74.030000000000001 110.915 -179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 26.7 mtt-85 -134.57 156.98 47.73 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.085 -0.507 . . . . 73.409999999999997 110.844 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 9.2 mt-10 -89.47 135.54 33.54 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.17 -0.468 . . . . 63.43 110.885 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.519 ' CE1' ' HB3' ' A' ' 487' ' ' ALA . 85.2 m-85 -123.62 123.54 40.79 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.106 -0.497 . . . . 62.219999999999999 110.892 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.464 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -103.61 107.95 19.01 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.171 -0.468 . . . . 65.120000000000005 110.928 179.983 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.554 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.4 t -100.57 121.59 51.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.449 . . . . 52.039999999999999 111.098 179.844 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.607 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 12.8 tttm -99.86 109.27 21.67 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.156 -0.475 . . . . 64.540000000000006 110.933 179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.622 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.9 mt -131.24 154.26 81.91 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.596 0.712 . . . . 75.530000000000001 110.95 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 162.14 43.22 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.731 2.287 . . . . 72.310000000000002 112.329 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.86 109.62 2.38 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.622 2.215 . . . . 64.420000000000002 112.32 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.5 mt -111.32 -171.19 1.78 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.179 -0.464 . . . . 71.010000000000005 110.941 179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 7.3 t -71.02 171.09 11.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.214 -0.448 . . . . 54.020000000000003 110.86 -179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -66.91 -48.18 69.5 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 74.030000000000001 110.873 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 31.0 mm-40 -59.07 -34.65 72.22 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.169 -0.469 . . . . 72.549999999999997 110.879 -179.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 23.7 mmt180 -66.32 -55.76 14.41 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.2 -0.455 . . . . 75.209999999999994 110.889 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 35.6 mtt180 -56.32 -43.27 78.81 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.191 -0.459 . . . . 75.140000000000001 110.868 -179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.3 mt -67.66 -39.35 84.54 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.209 -0.45 . . . . 75.519999999999996 110.938 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 9.7 mt-10 -66.31 -48.29 70.81 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 72.530000000000001 110.878 179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.412 HD11 HD23 ' A' ' 500' ' ' LEU . 21.4 tp -62.02 -51.11 69.35 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 65.409999999999997 110.943 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -58.37 -51.22 70.71 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.461 . . . . 72.200000000000003 110.883 179.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 12.0 mmm180 -57.96 -52.64 64.67 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.162 -0.472 . . . . 74.120000000000005 110.874 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 11.0 mt -52.85 -43.64 66.19 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.225 -0.443 . . . . 75.409999999999997 110.87 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.3 m-85 -60.63 -56.52 20.32 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.235 -0.438 . . . . 74.510000000000005 110.89 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.32 -13.29 60.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.177 -0.465 . . . . 70.319999999999993 111.09 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.61 -57.51 3.64 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.242 -0.436 . . . . 74.340000000000003 110.812 -179.738 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -88.38 -52.22 5.31 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.486 . . . . 74.019999999999996 110.883 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.541 HD21 HG11 ' A' ' 491' ' ' VAL . 2.0 tp -67.84 -12.42 60.59 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.179 -0.464 . . . . 64.099999999999994 110.883 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 57.13 23.47 8.59 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.22 -0.446 . . . . 72.140000000000001 110.919 179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.51 178.5 1.59 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.445 . . . . 64.510000000000005 111.07 179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 24.4 m -145.08 110.99 5.46 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.452 . . . . 73.040000000000006 111.124 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 61.0 t -54.22 124.8 7.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.21 -0.45 . . . . 54.32 111.113 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 41.2 mt -108.2 -47.32 3.56 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 73.409999999999997 110.921 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -151.94 174.06 14.08 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.148 -0.478 . . . . 51.329999999999998 111.105 179.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 91.2 p -172.23 148.75 2.19 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.259 -0.428 . . . . 44.310000000000002 110.852 -179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.688 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 22.1 pt-20 -140.49 140.68 35.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.132 -0.485 . . . . 74.140000000000001 110.855 -179.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . 0.45 ' OG1' HG23 ' A' ' 481' ' ' THR . 8.0 m -137.49 143.91 41.96 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 73.519999999999996 111.115 -179.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 80.5 t -91.61 110.79 23.04 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.176 -0.466 . . . . 64.430000000000007 111.123 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.323 0 C-N-CA 120.709 -0.757 . . . . 65.439999999999998 112.482 179.954 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 53.5 mtp . . . . . 0 C--O 1.232 0.141 0 CA-C-O 120.805 0.336 . . . . 73.25 110.827 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 34.7 m -127.77 173.52 12.91 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.282 -0.417 . . . . 73.310000000000002 111.118 179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 174.95 110.23 0.25 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.727 -0.749 . . . . 50.119999999999997 112.471 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -157.85 141.55 15.62 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.856 0.36 . . . . 75.310000000000002 110.895 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -161.41 142.7 11.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.126 -0.488 . . . . 73.239999999999995 110.848 -179.925 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 6.1 t80 -116.8 133.96 55.37 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 61.119999999999997 110.891 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 2.9 m -119.48 127.53 53.14 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.086 -0.506 . . . . 65.120000000000005 110.862 -179.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 19.9 pt -116.71 160.64 16.0 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.105 -0.498 . . . . 73.409999999999997 111.146 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 29.7 t0 -91.19 -21.5 21.1 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.209 -0.451 . . . . 71.120000000000005 110.878 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 12.6 t80 -51.94 -35.61 46.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.109999999999999 110.868 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . 0.483 HG21 ' HB3' ' A' ' 531' ' ' PRO . 1.5 m -69.07 146.32 52.72 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 74.140000000000001 111.1 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -103.61 -89.7 2.12 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.729 -0.748 . . . . 73.099999999999994 112.5 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -126.98 164.17 20.64 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.752 -0.737 . . . . 74.239999999999995 112.493 -179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 29.8 m -131.36 112.95 13.19 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.836 0.351 . . . . 73.209999999999994 111.135 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.775 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -95.02 127.68 41.27 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.196 -0.456 . . . . 52.039999999999999 111.121 179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.4 m-85 -116.4 109.84 17.87 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.451 . . . . 72.340000000000003 110.907 -179.817 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.585 HG23 HD23 ' A' ' 526' ' ' LEU . 0.5 OUTLIER -94.05 114.63 26.84 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.121 -0.49 . . . . 65.109999999999999 111.119 -179.964 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.454 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -137.33 143.56 42.12 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 61.219999999999999 110.927 179.916 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.753 ' HB2' HD11 ' A' ' 553' ' ' LEU . 19.6 ttm180 -95.86 143.15 27.32 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.203 -0.453 . . . . 72.219999999999999 110.865 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -145.77 171.03 15.37 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.174 -0.466 . . . . 74.420000000000002 111.1 179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -61.28 160.66 21.95 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.673 0.749 . . . . 74.530000000000001 110.87 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 -15.36 37.0 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.66 2.24 . . . . 71.109999999999999 112.357 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 7.9 t-20 -69.73 -46.72 65.3 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.196 -0.456 . . . . 71.310000000000002 110.881 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 41.0 t -68.81 127.79 31.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 72.450000000000003 111.177 179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 8.4 mt-10 -123.05 178.77 4.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.211 -0.449 . . . . 74.150000000000006 110.931 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 59.1 t -51.65 -47.77 37.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.155 -0.475 . . . . 74.0 111.133 179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -51.77 -40.18 59.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 54.210000000000001 110.923 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.1 m -71.12 -35.36 71.74 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.194 -0.457 . . . . 74.340000000000003 111.14 -179.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.579 ' CB ' HD13 ' A' ' 512' ' ' ILE . 3.6 mt -67.3 -45.65 75.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.207 -0.451 . . . . 75.409999999999997 110.924 179.949 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -68.87 -46.13 69.24 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.173 -0.467 . . . . 74.430000000000007 110.865 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 7.8 ptm180 -64.86 -32.28 73.92 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 72.040000000000006 110.822 -179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -73.42 -44.6 57.98 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 73.239999999999995 110.92 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 53.6 mt -63.74 -41.99 97.94 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.137 -0.483 . . . . 75.239999999999995 110.96 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -73.09 -37.71 66.64 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.188 -0.46 . . . . 73.129999999999995 110.949 179.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -62.32 -48.2 80.89 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.104 -0.498 . . . . 74.219999999999999 110.842 -179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt -67.78 -24.44 65.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.149 -0.478 . . . . 73.010000000000005 110.858 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -15.93 20.75 Favored Glycine 0 N--CA 1.451 -0.313 0 C-N-CA 120.756 -0.735 . . . . 64.540000000000006 112.505 179.958 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.505 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.6 m-85 -64.7 160.27 54.88 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.681 0.753 . . . . 72.019999999999996 110.853 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 91.09 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.698 2.266 . . . . 72.340000000000003 112.359 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -106.93 -28.16 5.11 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.717 -0.754 . . . . 61.039999999999999 112.518 179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 6.4 mmmm -64.38 -51.85 61.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.778 0.323 . . . . 73.540000000000006 110.92 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -75.66 -34.38 60.47 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.204 -0.453 . . . . 70.310000000000002 110.883 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.559 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -52.85 165.1 0.31 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 61.229999999999997 111.1 179.909 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.04 110.95 24.14 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.203 -0.453 . . . . 72.140000000000001 111.112 179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.579 HD13 ' CB ' ' A' ' 496' ' ' LEU . 61.1 mt -90.66 142.99 12.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.178 -0.465 . . . . 72.319999999999993 111.158 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -129.59 133.26 47.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 63.229999999999997 111.147 179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . 0.409 HE21 ' N ' ' A' ' 515' ' ' VAL . 26.6 tp60 -97.35 118.54 34.04 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.204 -0.453 . . . . 74.140000000000001 110.936 179.989 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . 0.409 ' N ' HE21 ' A' ' 514' ' ' GLN . 98.1 t -123.32 97.69 4.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.251 -0.431 . . . . 43.310000000000002 111.184 179.944 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 14.4 tm0? -74.87 99.06 3.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.430000000000007 110.908 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.592 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -66.98 160.32 70.83 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.567 0.699 . . . . 65.329999999999998 111.133 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.592 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.78 74.41 1.3 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.707 2.271 . . . . 62.340000000000003 112.354 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.9 t 179.1 140.21 0.1 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.231 -0.44 . . . . 74.239999999999995 111.097 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.41 33.24 1.62 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 71.109999999999999 111.111 179.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.63 -33.94 3.51 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 72.150000000000006 111.122 179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 13.0 m-85 -147.74 176.97 9.68 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.215 -0.448 . . . . 65.329999999999998 110.918 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 81.5 mtt180 -148.06 149.12 31.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.143 -0.48 . . . . 63.039999999999999 110.891 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -91.9 138.84 31.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.183 -0.462 . . . . 72.540000000000006 110.938 -179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 63.9 m-85 -130.64 133.77 46.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.151 -0.477 . . . . 72.439999999999998 110.936 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.585 HD23 HG23 ' A' ' 484' ' ' THR . 0.6 OUTLIER -109.44 106.08 15.7 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.2 -0.454 . . . . 73.230000000000004 110.889 -179.935 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.652 HG12 HD21 ' A' ' 529' ' ' LEU . 21.2 t -96.02 112.27 27.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.209 -0.451 . . . . 60.5 111.139 179.827 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.502 ' O ' HD23 ' A' ' 529' ' ' LEU . 35.3 tttp -90.47 112.11 23.63 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.173 -0.467 . . . . 73.310000000000002 110.913 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.652 HD21 HG12 ' A' ' 527' ' ' VAL . 6.5 mt -132.67 154.28 81.42 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.592 0.711 . . . . 72.109999999999999 110.895 179.927 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 162.2 42.99 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.67 2.247 . . . . 71.120000000000005 112.342 179.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . 0.483 ' HB3' HG21 ' A' ' 478' ' ' THR . 53.9 Cg_endo -69.75 107.46 1.86 Allowed 'Trans proline' 0 C--O 1.232 0.208 0 C-N-CA 122.665 2.244 . . . . 73.409999999999997 112.361 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -109.12 -170.99 1.76 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.195 -0.457 . . . . 71.349999999999994 110.958 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 7.8 p -72.74 152.05 41.83 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.205 -0.452 . . . . 74.519999999999996 110.89 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -51.94 -41.18 61.84 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.154 -0.475 . . . . 70.129999999999995 110.864 179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 21.1 mt-10 -62.09 -43.93 97.77 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.198 -0.455 . . . . 62.149999999999999 110.858 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 2.8 mmp_? -64.64 -48.48 74.68 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.195 -0.457 . . . . 74.319999999999993 110.903 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 31.5 mtt180 -56.41 -52.98 62.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.211 -0.449 . . . . 73.230000000000004 110.858 -179.925 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -64.34 -40.51 96.03 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.166 -0.47 . . . . 74.340000000000003 110.925 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -61.46 -46.17 91.18 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 55.149999999999999 110.848 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.505 HD22 ' CD2' ' A' ' 505' ' ' PHE . 24.0 tp -64.01 -51.06 65.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.204 -0.453 . . . . 44.119999999999997 110.863 -179.933 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -57.78 -50.12 74.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.205 -0.452 . . . . 72.540000000000006 110.871 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 5.7 mmp_? -57.94 -53.44 58.17 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.179 -0.464 . . . . 63.350000000000001 110.899 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . 0.447 HD23 ' O ' ' A' ' 543' ' ' LEU . 3.0 tt -52.63 -43.37 65.38 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 64.450000000000003 110.922 179.993 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.1 m-85 -60.63 -56.53 20.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.179 -0.464 . . . . 75.209999999999994 110.894 179.927 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.43 -13.3 60.56 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 52.109999999999999 111.063 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -79.59 -57.3 3.75 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.255 -0.429 . . . . 73.030000000000001 110.882 -179.805 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -88.36 -52.24 5.31 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.14 -0.482 . . . . 73.409999999999997 110.914 -179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -67.86 -12.42 60.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.138 -0.483 . . . . 75.540000000000006 110.933 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 29.0 mmmt 57.45 23.27 8.88 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.168 -0.469 . . . . 74.340000000000003 110.901 179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.26 -179.05 0.92 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 73.430000000000007 111.075 179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 89.8 m -145.01 110.95 5.46 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.213 -0.448 . . . . 70.129999999999995 111.171 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 31.7 t -55.62 108.53 0.2 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 72.299999999999997 111.149 179.939 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . 0.753 HD11 ' HB2' ' A' ' 486' ' ' ARG . 27.2 mt -85.43 -43.19 13.83 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 73.519999999999996 110.925 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -166.54 174.54 8.77 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.208 -0.451 . . . . 64.310000000000002 111.059 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 75.7 m -161.38 148.93 15.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.2 -0.454 . . . . 73.230000000000004 110.845 -179.777 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.775 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 24.9 pt-20 -143.88 154.7 43.63 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 71.400000000000006 110.874 -179.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 10.4 m -144.21 129.71 19.01 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 61.420000000000002 111.16 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 21.8 t -79.87 103.27 6.64 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.217 -0.447 . . . . 73.340000000000003 111.135 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.711 -0.757 . . . . 51.409999999999997 112.418 -179.975 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 17.9 ptp . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.798 0.332 . . . . 64.209999999999994 110.91 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 27.8 m -110.77 138.26 39.65 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.255 -0.43 . . . . 74.430000000000007 111.135 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -68.03 -140.8 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.764 -0.732 . . . . 63.219999999999999 112.515 179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -119.7 -56.98 2.0 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.879 0.371 . . . . 75.099999999999994 110.915 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 11.8 p30 -141.0 149.24 41.52 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.133 -0.485 . . . . 74.040000000000006 110.867 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -148.4 128.54 13.7 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.147 -0.479 . . . . 73.519999999999996 110.926 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 17.6 m -146.44 161.29 40.73 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.128 -0.487 . . . . 74.450000000000003 110.901 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 32.5 mm -104.38 136.67 36.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.155 -0.475 . . . . 72.040000000000006 111.119 179.977 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.3 t70 -113.14 -21.51 10.99 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.152 -0.476 . . . . 73.540000000000006 110.897 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 10.4 t80 62.95 35.95 12.99 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.224 -0.444 . . . . 72.510000000000005 110.868 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . 0.445 HG23 ' O ' ' A' ' 558' ' ' VAL . 34.4 m -72.3 137.41 46.67 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.146 -0.479 . . . . 75.310000000000002 111.117 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -69.33 -110.46 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.735 -0.745 . . . . 60.310000000000002 112.473 179.956 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -113.61 160.57 13.08 Favored Glycine 0 N--CA 1.45 -0.367 0 C-N-CA 120.747 -0.739 . . . . 73.040000000000006 112.507 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 61.3 m -125.13 114.15 18.65 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.823 0.344 . . . . 71.409999999999997 111.129 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.769 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -98.87 138.71 35.61 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.199 -0.455 . . . . 71.409999999999997 111.085 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 -123.89 112.13 16.88 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.256 -0.429 . . . . 74.430000000000007 110.916 -179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.8 m -93.89 110.14 21.81 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.109 -0.496 . . . . 73.140000000000001 111.112 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.481 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.7 pt? -132.57 145.35 51.05 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.225 -0.443 . . . . 73.200000000000003 110.938 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 23.5 ttp180 -100.0 129.01 46.01 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.192 -0.458 . . . . 75.420000000000002 110.866 179.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -131.83 170.97 14.12 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.217 -0.447 . . . . 63.210000000000001 111.083 179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -58.19 160.26 9.49 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.643 0.735 . . . . 62.329999999999998 110.86 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -15.66 37.17 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.724 2.282 . . . . 74.010000000000005 112.324 179.962 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -71.7 -45.56 61.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.226 -0.443 . . . . 64.099999999999994 110.93 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.532 HG11 HD21 ' A' ' 548' ' ' LEU . 99.2 t -61.42 121.11 8.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.199 -0.455 . . . . 63.329999999999998 111.123 179.872 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 12.8 mt-10 -117.07 173.79 6.47 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.173 -0.467 . . . . 73.319999999999993 110.913 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.5 t -51.56 -48.5 35.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 51.439999999999998 111.111 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -52.44 -39.81 61.47 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.164 -0.471 . . . . 52.340000000000003 110.896 180.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.3 m -71.2 -35.58 71.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.157 -0.474 . . . . 65.349999999999994 111.151 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.759 ' HB3' HD13 ' A' ' 512' ' ' ILE . 2.8 mt -67.36 -45.58 75.89 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 74.239999999999995 110.908 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.6 ptt85 -69.0 -46.05 69.01 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.165 -0.471 . . . . 72.340000000000003 110.892 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -64.86 -32.12 73.68 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 74.409999999999997 110.82 -179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.6 t80 -73.36 -45.64 53.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.222 -0.445 . . . . 74.340000000000003 110.861 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 49.2 mt -62.86 -42.1 99.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 73.140000000000001 110.891 -179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.4 pt-20 -73.06 -37.65 66.75 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.253 -0.431 . . . . 73.209999999999994 110.902 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 22.2 tt0 -61.38 -48.92 79.02 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.142 -0.481 . . . . 72.450000000000003 110.955 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 31.8 mmmt -67.51 -22.78 65.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.121 -0.491 . . . . 61.049999999999997 110.907 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -18.43 18.95 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.739 -0.743 . . . . 74.109999999999999 112.474 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.493 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.4 m-85 -66.08 160.3 64.74 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.664 0.745 . . . . 74.120000000000005 110.876 -179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 101.93 0.97 Allowed 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.71 2.273 . . . . 70.549999999999997 112.319 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -120.72 -30.55 1.36 Allowed Glycine 0 N--CA 1.452 -0.248 0 C-N-CA 120.731 -0.747 . . . . 75.329999999999998 112.472 179.937 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.2 -42.28 65.98 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.707 0.289 . . . . 71.310000000000002 110.882 -179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -80.46 -36.83 32.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 73.409999999999997 110.898 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.627 ' HB1' ' O ' ' A' ' 528' ' ' LYS . . . -59.21 177.46 0.17 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.159 -0.473 . . . . 72.239999999999995 111.068 179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.0 112.52 29.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.184 -0.462 . . . . 73.519999999999996 111.123 179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.759 HD13 ' HB3' ' A' ' 496' ' ' LEU . 47.3 mt -96.16 128.06 47.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.165 -0.47 . . . . 54.210000000000001 111.12 179.938 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -122.98 147.21 46.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.195 -0.457 . . . . 61.450000000000003 111.122 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.5 tm0? -103.61 144.02 31.99 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.183 -0.462 . . . . 74.310000000000002 110.927 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 94.5 t -136.57 108.73 7.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.184 -0.462 . . . . 71.319999999999993 111.127 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -81.01 109.72 15.87 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 74.150000000000006 110.951 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.589 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -89.44 160.32 42.39 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.561 0.696 . . . . 71.099999999999994 111.139 179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.589 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.8 Cg_endo -69.75 74.44 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.696 2.264 . . . . 73.239999999999995 112.35 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t 179.27 136.54 0.1 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.185 -0.461 . . . . 75.200000000000003 111.127 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -96.46 32.32 2.04 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.239 -0.437 . . . . 43.210000000000001 111.07 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.97 -34.16 3.41 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 44.549999999999997 111.092 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 -150.81 145.67 25.86 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.208 -0.451 . . . . 74.340000000000003 110.944 -179.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 11.0 mpt_? -115.98 154.39 29.93 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.117 -0.492 . . . . 74.430000000000007 110.87 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . 0.549 ' HG2' HD12 ' A' ' 553' ' ' LEU . 7.2 mt-10 -92.18 149.23 21.6 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.216 -0.447 . . . . 72.129999999999995 110.893 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -138.96 133.51 31.89 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.113 -0.494 . . . . 73.409999999999997 110.907 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.769 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.4 OUTLIER -109.15 106.8 16.83 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.131 -0.486 . . . . 52.439999999999998 110.937 -179.968 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.596 HG12 HD21 ' A' ' 529' ' ' LEU . 19.9 t -95.97 113.27 29.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 63.25 111.159 179.859 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.627 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 2.9 tptm -92.46 108.57 20.06 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.239999999999995 110.901 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.621 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -132.45 154.55 81.6 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.608 0.718 . . . . 73.400000000000006 110.907 179.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 162.29 42.62 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.719 2.28 . . . . 63.520000000000003 112.382 179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 103.98 1.25 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.7 2.267 . . . . 72.049999999999997 112.334 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.4 mt -103.62 -171.05 1.87 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.201 -0.454 . . . . 73.430000000000007 110.917 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 28.4 t -70.22 149.06 47.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.203 -0.453 . . . . 62.100000000000001 110.815 -179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -51.71 -48.45 63.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.113 -0.494 . . . . 75.420000000000002 110.848 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -61.1 -44.82 96.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 72.430000000000007 110.927 -179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 21.7 mmt85 -59.07 -55.85 29.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.129 -0.487 . . . . 73.150000000000006 110.843 -179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 67.4 mtp180 -53.83 -53.0 58.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.196 -0.456 . . . . 73.310000000000002 110.881 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.1 mt -56.41 -37.01 69.59 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.168 -0.469 . . . . 75.030000000000001 110.903 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 35.0 tt0 -65.0 -46.0 83.24 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 73.310000000000002 110.864 179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.493 HD22 ' CD2' ' A' ' 505' ' ' PHE . 22.1 tp -61.44 -50.86 71.09 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 61.210000000000001 110.906 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -57.3 -50.91 71.44 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.201 -0.454 . . . . 75.030000000000001 110.902 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 88.1 mtt180 -58.04 -52.71 64.38 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.132 -0.486 . . . . 62.229999999999997 110.85 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 2.4 tt -52.6 -44.19 65.83 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.209 -0.45 . . . . 61.32 110.913 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -60.43 -56.29 23.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.2 -0.455 . . . . 73.209999999999994 110.928 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.01 -13.43 59.88 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.158 -0.474 . . . . 71.439999999999998 111.142 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.9 t -79.66 -57.72 3.54 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.451 . . . . 64.439999999999998 110.887 -179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -88.29 -52.18 5.35 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.118 -0.492 . . . . 73.299999999999997 110.91 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.532 HD21 HG11 ' A' ' 491' ' ' VAL . 0.8 OUTLIER -67.82 -12.43 60.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.118 -0.492 . . . . 74.409999999999997 110.944 -179.979 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 26.8 mmtp 56.74 24.0 8.55 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.197 -0.456 . . . . 74.409999999999997 110.867 179.799 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.77 177.72 1.98 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.227 -0.442 . . . . 73.430000000000007 111.076 179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 40.8 m -140.28 110.87 6.76 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.192 -0.458 . . . . 71.040000000000006 111.136 -179.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 41.3 t -59.51 102.03 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 64.439999999999998 111.137 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . 0.549 HD12 ' HG2' ' A' ' 524' ' ' GLU . 28.6 mt -77.85 -43.25 30.9 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 75.400000000000006 110.917 179.967 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -168.55 176.44 5.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 53.219999999999999 111.109 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 99.2 p -160.18 153.94 22.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.208 -0.451 . . . . 60.109999999999999 110.864 -179.767 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.753 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 8.2 pm0 -142.1 153.39 44.11 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.466 . . . . 74.230000000000004 110.895 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 47.3 m -144.29 131.68 20.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.178 -0.464 . . . . 75.439999999999998 111.125 -179.921 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . 0.445 ' O ' HG23 ' A' ' 478' ' ' THR . 43.5 t -76.56 96.89 1.49 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.264 0 CA-C-N 116.194 -0.457 . . . . 54.210000000000001 111.146 179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 C-N-CA 120.755 -0.736 . . . . 62.420000000000002 112.451 -179.989 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.114 0 CA-C-O 120.83 0.348 . . . . 75.209999999999994 110.855 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 26.8 m -91.15 141.86 13.81 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.191 -0.458 . . . . 44.039999999999999 111.137 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 129.34 42.87 0.22 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.747 -0.74 . . . . 52.350000000000001 112.504 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 35.1 t80 -124.08 73.15 1.21 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.86 0.362 . . . . 63.399999999999999 110.858 -179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 32.1 t30 -94.43 -28.01 15.72 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.121 -0.491 . . . . 71.450000000000003 110.926 179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -72.79 112.79 9.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.132 -0.486 . . . . 72.349999999999994 110.908 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 32.6 p -162.91 126.25 2.83 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.119 -0.492 . . . . 73.319999999999993 110.881 -179.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 47.2 mt -105.88 144.7 14.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 74.409999999999997 111.118 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -124.19 68.38 1.06 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.173 -0.467 . . . . 74.329999999999998 110.847 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -142.43 165.17 28.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 72.400000000000006 110.826 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 8.9 t -151.01 163.92 37.62 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.111 -0.495 . . . . 75.219999999999999 111.092 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 129.72 -58.42 0.71 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.726 -0.75 . . . . 72.129999999999995 112.495 179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 111.42 150.27 11.67 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.767 -0.73 . . . . 54.530000000000001 112.465 -179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . 0.464 HG23 ' O ' ' A' ' 556' ' ' GLU . 25.7 m -128.52 113.4 15.44 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-O 120.825 0.345 . . . . 74.0 111.116 -179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.795 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -94.91 142.64 27.24 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.197 -0.456 . . . . 64.310000000000002 111.123 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 -132.11 110.67 10.85 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.244 -0.435 . . . . 74.420000000000002 110.921 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.638 HG22 ' OE2' ' A' ' 524' ' ' GLU . 0.2 OUTLIER -96.73 114.78 26.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.153 -0.476 . . . . 63.240000000000002 111.123 -179.967 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.442 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.7 pt? -135.76 142.56 44.97 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.231 -0.44 . . . . 62.340000000000003 110.962 179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 28.4 ttp180 -88.3 146.94 25.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.235 -0.439 . . . . 63.530000000000001 110.865 179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -152.54 169.73 21.9 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 44.439999999999998 111.131 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -70.49 160.66 80.61 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.669 0.747 . . . . 70.230000000000004 110.861 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 -10.95 29.76 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.669 2.246 . . . . 74.319999999999993 112.301 179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 11.1 m-80 -71.29 -31.15 67.12 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.249 -0.432 . . . . 73.219999999999999 110.872 -179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 23.7 t -86.83 134.77 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.139 -0.482 . . . . 75.310000000000002 111.134 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -127.06 177.56 6.57 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.222 -0.445 . . . . 74.439999999999998 110.9 -179.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 81.8 t -51.96 -50.01 35.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 54.039999999999999 111.131 179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -53.72 -40.07 65.77 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.186 -0.461 . . . . 73.549999999999997 110.923 -179.987 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 63.7 m -67.52 -42.8 82.21 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.156 -0.475 . . . . 72.430000000000007 111.162 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.542 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.6 mt -61.21 -51.06 70.58 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.191 -0.459 . . . . 63.109999999999999 110.933 179.968 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . 0.401 ' HB3' HD12 ' A' ' 512' ' ' ILE . 9.4 ptm180 -64.1 -40.12 95.53 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.152 -0.476 . . . . 72.120000000000005 110.85 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 62.8 mtt180 -60.46 -44.12 96.21 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.201 -0.454 . . . . 65.439999999999998 110.835 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 10.8 t80 -70.81 -39.55 73.01 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.231 -0.441 . . . . 72.310000000000002 110.877 -179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.545 HD12 HD11 ' A' ' 512' ' ' ILE . 36.0 mt -58.87 -49.9 76.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 73.340000000000003 110.917 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -72.13 -37.98 69.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.154 -0.476 . . . . 74.310000000000002 110.886 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -56.06 -48.75 75.46 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.167 -0.47 . . . . 61.100000000000001 110.914 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.537 ' HE2' HD13 ' A' ' 543' ' ' LEU . 13.7 mmmt -69.71 -23.7 63.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.158 -0.473 . . . . 73.209999999999994 110.948 179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.0 -17.68 19.64 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.758 -0.734 . . . . 62.219999999999999 112.495 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -63.4 160.26 43.39 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.628 0.728 . . . . 62.140000000000001 110.881 -179.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 93.39 0.52 Allowed 'Trans proline' 0 N--CA 1.465 -0.174 0 C-N-CA 122.673 2.249 . . . . 43.229999999999997 112.348 -179.981 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.16 -28.23 3.41 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.705 -0.76 . . . . 52.310000000000002 112.468 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 24.5 mmmt -70.43 -51.74 27.23 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.718 0.294 . . . . 74.439999999999998 110.888 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.38 -34.34 67.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.208 -0.451 . . . . 75.030000000000001 110.932 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.652 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -61.46 172.32 1.2 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.135 -0.484 . . . . 62.32 111.107 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.97 116.47 44.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.252 -0.431 . . . . 55.530000000000001 111.101 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.545 HD11 HD12 ' A' ' 500' ' ' LEU . 65.5 mt -98.36 123.2 50.75 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.192 -0.458 . . . . 73.430000000000007 111.158 179.855 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 1.7 m -113.91 143.15 45.18 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.189 -0.46 . . . . 62.030000000000001 111.12 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -98.16 128.91 44.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.182 -0.463 . . . . 73.400000000000006 110.923 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 90.7 t -119.72 92.27 2.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.236 -0.438 . . . . 72.420000000000002 111.16 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -65.7 114.85 5.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 61.439999999999998 110.929 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.606 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -88.64 161.17 42.79 Favored Pre-proline 0 C--N 1.33 -0.279 0 CA-C-O 121.56 0.695 . . . . 64.129999999999995 111.128 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.606 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.76 72.17 1.47 Allowed 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.762 2.308 . . . . 73.310000000000002 112.325 -179.967 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.4 t 177.23 141.9 0.08 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.201 -0.454 . . . . 74.120000000000005 111.15 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.87 31.35 2.12 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.456 . . . . 52.32 111.138 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -126.06 -35.67 2.43 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.2 -0.455 . . . . 71.129999999999995 111.06 179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.582 ' O ' HG23 ' A' ' 519' ' ' THR . 18.0 m-85 -150.1 150.55 31.84 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.226 -0.443 . . . . 63.420000000000002 110.898 -179.876 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -135.18 161.76 34.45 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.096 -0.502 . . . . 70.319999999999993 110.859 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . 0.667 ' OE1' HD12 ' A' ' 553' ' ' LEU . 41.1 tp10 -94.71 152.38 18.51 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.163 -0.471 . . . . 64.510000000000005 110.869 -179.946 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 19.6 m-85 -136.31 126.94 27.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.117 -0.492 . . . . 72.230000000000004 110.868 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.795 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -98.61 107.46 19.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.143 -0.481 . . . . 72.430000000000007 110.896 -179.972 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.554 HG12 HD21 ' A' ' 529' ' ' LEU . 21.4 t -95.88 112.02 27.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.165 -0.47 . . . . 75.409999999999997 111.114 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.61 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 0.8 OUTLIER -91.55 108.44 19.91 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.16 -0.473 . . . . 71.319999999999993 110.903 179.878 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.652 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.3 mt -131.86 154.47 81.77 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.605 0.717 . . . . 74.230000000000004 110.893 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 162.22 42.94 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.675 2.25 . . . . 63.439999999999998 112.352 179.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 106.45 1.67 Allowed 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.733 2.289 . . . . 70.420000000000002 112.317 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.3 mt -108.83 -171.02 1.77 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.175 -0.466 . . . . 74.340000000000003 110.941 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 53.7 m -71.79 153.83 41.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 74.549999999999997 110.848 -179.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -52.27 -47.44 65.81 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.128 -0.487 . . . . 60.310000000000002 110.844 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 50.1 mm-40 -58.95 -37.77 77.51 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 72.310000000000002 110.926 -179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.4 mmp_? -64.22 -58.04 7.74 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.461 . . . . 71.219999999999999 110.839 -179.911 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 66.9 mtm180 -53.1 -47.02 68.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.173 -0.467 . . . . 73.209999999999994 110.873 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mt -66.01 -37.04 84.89 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.186 -0.461 . . . . 63.329999999999998 110.882 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -65.97 -46.66 77.26 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.184 -0.462 . . . . 73.120000000000005 110.831 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -63.99 -51.18 65.51 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.182 -0.463 . . . . 73.230000000000004 110.921 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 36.0 mt-10 -58.14 -50.45 73.47 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.175 -0.466 . . . . 71.540000000000006 110.854 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 63.9 mtp180 -58.05 -53.41 58.51 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.185 -0.461 . . . . 72.019999999999996 110.878 -179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . 0.537 HD13 ' HE2' ' A' ' 503' ' ' LYS . 7.9 mt -52.63 -43.59 65.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.173 -0.467 . . . . 71.319999999999993 110.941 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.53 -56.56 19.86 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.195 -0.457 . . . . 75.409999999999997 110.857 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.26 -13.32 60.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.101 -0.5 . . . . 61.310000000000002 111.1 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 22.8 t -79.6 -57.39 3.7 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.449 . . . . 75.219999999999999 110.845 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -88.4 -52.18 5.33 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.158 -0.474 . . . . 74.219999999999999 110.879 -179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -67.82 -12.36 60.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.135 -0.484 . . . . 71.549999999999997 110.91 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.5 mmmt 57.11 23.58 8.68 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 71.239999999999995 110.894 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.95 177.86 1.57 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.237 -0.438 . . . . 74.439999999999998 111.077 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 49.1 m -140.39 111.01 6.79 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.217 -0.447 . . . . 75.129999999999995 111.12 -179.921 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 61.8 t -60.47 119.56 4.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.202 -0.454 . . . . 63.109999999999999 111.108 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . 0.667 HD12 ' OE1' ' A' ' 524' ' ' GLU . 17.6 mt -103.09 -48.03 4.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.466 . . . . 55.119999999999997 110.89 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -143.61 170.09 16.49 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.194 -0.457 . . . . 64.099999999999994 111.073 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 54.8 p -175.8 133.99 0.28 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 64.140000000000001 110.851 -179.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.464 ' O ' HG23 ' A' ' 481' ' ' THR . 4.3 pt-20 -128.28 140.54 51.83 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.127 -0.488 . . . . 73.049999999999997 110.877 -179.974 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . 0.411 HG23 ' OG1' ' A' ' 481' ' ' THR . 3.3 m -133.14 146.54 51.67 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 75.319999999999993 111.168 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 40.0 t -114.73 111.97 38.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 65.409999999999997 111.153 179.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 C-N-CA 120.768 -0.73 . . . . 62.119999999999997 112.511 179.991 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 3.6 ptp . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.838 0.351 . . . . 60.310000000000002 110.866 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 9.3 p -165.93 141.1 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.44 . . . . 72.030000000000001 111.168 179.963 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -162.87 89.41 0.11 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.792 -0.718 . . . . 65.129999999999995 112.474 -179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 28.5 m-85 -147.26 134.08 20.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.85 0.357 . . . . 74.319999999999993 110.864 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -164.72 137.49 4.71 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 71.239999999999995 110.911 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 10.9 p90 -134.48 149.67 50.74 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.19 -0.459 . . . . 73.010000000000005 110.915 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 87.9 p -129.08 179.17 5.91 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 54.009999999999998 110.869 -179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 2.7 pp -147.28 -177.16 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.126 -0.488 . . . . 70.439999999999998 111.119 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -163.93 112.13 1.17 Allowed 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.191 -0.458 . . . . 75.319999999999993 110.893 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -153.88 137.82 16.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.244 -0.435 . . . . 74.120000000000005 110.888 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 11.9 m -125.92 125.67 43.16 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.133 -0.485 . . . . 63.520000000000003 111.123 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . 0.449 ' HA3' HG21 ' A' ' 558' ' ' VAL . . . 161.14 -69.01 0.24 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.749 -0.738 . . . . 64.239999999999995 112.511 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 133.24 149.52 6.14 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.72 -0.752 . . . . 71.200000000000003 112.477 -179.926 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 97.0 m -129.95 106.89 8.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.783 0.325 . . . . 73.400000000000006 111.126 -179.833 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.708 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -94.97 136.42 35.3 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.186 -0.461 . . . . 54.520000000000003 111.121 179.86 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -124.2 111.18 15.58 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.252 -0.431 . . . . 73.099999999999994 110.906 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.504 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.5 OUTLIER -94.92 110.97 22.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.062 -0.517 . . . . 73.200000000000003 111.172 -180.0 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.441 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -135.73 146.38 47.63 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.246 -0.434 . . . . 63.240000000000002 110.937 179.946 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.59 ' HD3' HD11 ' A' ' 553' ' ' LEU . 26.1 mtp180 -97.4 127.22 43.18 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.16 -0.473 . . . . 73.530000000000001 110.868 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . 0.448 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -123.84 171.06 9.95 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.149 -0.478 . . . . 61.32 111.134 179.892 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.6 mt-10 -66.29 160.63 63.88 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.667 0.746 . . . . 72.25 110.901 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 -16.3 37.63 Favored 'Trans proline' 0 C--N 1.341 0.147 0 C-N-CA 122.692 2.261 . . . . 73.219999999999999 112.366 -179.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 1.4 p-10 -72.5 -34.02 67.35 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.208 -0.451 . . . . 64.439999999999998 110.887 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 85.4 t -80.14 124.59 38.33 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.154 -0.475 . . . . 71.530000000000001 111.132 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 27.1 mt-10 -118.61 178.85 4.31 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.21 -0.45 . . . . 74.540000000000006 110.878 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 38.7 t -51.62 -48.73 36.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.144 -0.48 . . . . 75.239999999999995 111.158 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -51.71 -41.12 61.26 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.193 -0.458 . . . . 65.540000000000006 110.882 -179.997 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.4 m -71.09 -34.55 71.26 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.128 -0.487 . . . . 54.299999999999997 111.14 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.778 ' HB3' HD13 ' A' ' 512' ' ' ILE . 2.3 mt -67.48 -44.54 78.3 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.209 -0.451 . . . . 72.150000000000006 110.872 179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.8 ptp180 -70.08 -45.55 66.77 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.257 -0.429 . . . . 65.209999999999994 110.849 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -65.05 -32.62 74.43 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.222 -0.444 . . . . 72.150000000000006 110.84 -179.902 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 33.5 t80 -73.58 -46.3 48.03 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 74.019999999999996 110.884 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 41.4 mt -61.7 -42.3 98.76 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.161 -0.472 . . . . 74.450000000000003 110.893 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -73.24 -37.55 66.33 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.183 -0.462 . . . . 71.349999999999994 110.907 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 73.2 tt0 -60.58 -49.31 78.05 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.148 -0.478 . . . . 75.129999999999995 110.897 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -64.35 -24.02 67.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.164 -0.471 . . . . 72.439999999999998 110.918 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.07 -17.73 19.43 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.794 -0.717 . . . . 75.319999999999993 112.518 179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.464 ' CD2' HD22 ' A' ' 540' ' ' LEU . 15.3 m-85 -68.01 160.3 75.05 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.666 0.746 . . . . 60.439999999999998 110.852 -179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 100.25 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.693 2.262 . . . . 72.209999999999994 112.29 -179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -119.85 -25.19 2.62 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.757 -0.735 . . . . 55.140000000000001 112.458 179.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 10.6 ptpt -72.88 -40.18 65.83 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.735 0.302 . . . . 71.219999999999999 110.914 -179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -85.23 -34.29 22.03 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.238 -0.437 . . . . 75.200000000000003 110.873 179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.633 ' HB1' ' O ' ' A' ' 528' ' ' LYS . . . -61.43 -177.95 0.11 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.222 -0.445 . . . . 64.329999999999998 111.087 179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 23.4 t -126.98 143.06 41.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 54.32 111.108 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.778 HD13 ' HB3' ' A' ' 496' ' ' LEU . 30.6 mt -125.61 120.4 57.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.174 -0.466 . . . . 52.539999999999999 111.129 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -118.53 141.6 48.41 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 74.299999999999997 111.163 179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -100.37 141.65 32.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.235 -0.439 . . . . 70.530000000000001 110.91 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 93.2 t -135.0 108.55 10.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.228 -0.442 . . . . 71.530000000000001 111.164 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 12.4 tm0? -71.19 116.74 11.84 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.221 -0.445 . . . . 74.430000000000007 110.947 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.581 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -96.22 160.23 30.3 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.575 0.702 . . . . 61.140000000000001 111.129 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.581 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.8 Cg_endo -69.76 74.6 1.28 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.663 2.242 . . . . 60.539999999999999 112.306 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.538 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.3 t 179.99 138.25 0.12 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.245 -0.434 . . . . 73.230000000000004 111.1 179.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.48 27.18 3.49 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.173 -0.467 . . . . 64.129999999999995 111.09 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.53 -34.93 3.17 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.245 -0.434 . . . . 75.120000000000005 111.081 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.538 ' O ' HG23 ' A' ' 519' ' ' THR . 14.1 m-85 -144.98 164.75 30.19 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.184 -0.462 . . . . 73.420000000000002 110.943 -179.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 48.9 mtm180 -137.33 160.61 38.56 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 63.310000000000002 110.898 -179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -93.98 149.31 21.35 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 72.019999999999996 110.886 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.448 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 83.1 m-85 -142.43 134.57 27.45 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.149 -0.478 . . . . 72.230000000000004 110.848 -179.928 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.708 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -108.36 107.72 18.41 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.095 -0.502 . . . . 64.129999999999995 110.91 -179.96 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.575 HG12 HD21 ' A' ' 529' ' ' LEU . 21.3 t -96.2 112.46 28.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 72.450000000000003 111.1 179.851 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.633 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 34.7 tttt -91.93 108.93 20.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.145 -0.479 . . . . 73.329999999999998 110.901 179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.632 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.3 mt -131.89 154.42 81.74 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.631 0.729 . . . . 52.130000000000003 110.89 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 162.25 42.79 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.627 2.218 . . . . 71.219999999999999 112.341 179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.81 112.42 3.08 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.678 2.252 . . . . 64.109999999999999 112.308 179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -112.79 -170.98 1.77 Allowed 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.246 -0.434 . . . . 63.140000000000001 110.91 179.979 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 40.9 t -68.88 155.51 40.12 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 35.020000000000003 110.844 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -54.73 -50.31 68.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.161 -0.472 . . . . 54.140000000000001 110.905 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -60.06 -37.16 79.04 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.191 -0.458 . . . . 64.310000000000002 110.881 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 35.7 mmt180 -64.19 -55.6 20.55 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 75.400000000000006 110.893 -179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 53.7 mtm180 -55.81 -53.06 61.27 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.199 -0.455 . . . . 73.540000000000006 110.844 -179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.0 mt -59.23 -37.77 78.35 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.237 -0.438 . . . . 71.120000000000005 110.897 -179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -64.93 -50.07 67.89 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.216 -0.447 . . . . 65.439999999999998 110.877 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.464 HD22 ' CD2' ' A' ' 505' ' ' PHE . 23.0 tp -57.92 -51.08 71.12 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.157 -0.474 . . . . 60.210000000000001 110.922 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . 0.402 ' OE1' HG22 ' A' ' 552' ' ' VAL . 17.2 mm-40 -57.26 -50.89 71.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.2 -0.454 . . . . 74.209999999999994 110.869 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 7.2 mmm180 -57.88 -51.91 67.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.147 -0.479 . . . . 52.420000000000002 110.878 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -52.8 -44.65 66.75 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.129 -0.487 . . . . 71.099999999999994 110.851 -179.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -60.39 -56.35 22.46 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.205 -0.452 . . . . 73.430000000000007 110.878 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.87 -13.47 59.66 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 73.340000000000003 111.102 179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.61 -57.96 3.42 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.203 -0.453 . . . . 75.209999999999994 110.859 -179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -88.26 -52.2 5.35 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.123 -0.489 . . . . 75.349999999999994 110.907 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.76 -12.47 60.63 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 73.540000000000006 110.871 -179.942 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 22.6 mmmt 56.3 24.37 8.2 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.205 -0.452 . . . . 75.120000000000005 110.905 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.41 174.14 3.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.203 -0.453 . . . . 72.420000000000002 111.091 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 93.3 m -133.72 111.69 10.78 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.236 -0.438 . . . . 73.409999999999997 111.13 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . 0.402 HG22 ' OE1' ' A' ' 541' ' ' GLU . 42.8 t -59.98 109.04 0.43 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.192 -0.458 . . . . 50.409999999999997 111.15 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . 0.59 HD11 ' HD3' ' A' ' 486' ' ' ARG . 11.7 mt -86.84 -45.38 10.93 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.161 -0.472 . . . . 75.409999999999997 110.922 179.996 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.61 172.38 14.4 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.144 -0.48 . . . . 70.129999999999995 111.144 179.737 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 20.6 p -158.26 157.37 32.41 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.24 -0.436 . . . . 73.239999999999995 110.877 -179.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -136.45 139.63 42.51 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.148 -0.478 . . . . 75.430000000000007 110.892 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 87.1 m -142.07 144.79 33.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.135 -0.484 . . . . 65.439999999999998 111.16 -179.896 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . 0.449 HG21 ' HA3' ' A' ' 479' ' ' GLY . 51.5 t -98.52 111.94 29.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.235 -0.439 . . . . 71.019999999999996 111.114 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.391 0 C-N-CA 120.759 -0.734 . . . . 55.219999999999999 112.517 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 4.0 mpp? . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.782 0.325 . . . . 75.310000000000002 110.893 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 9.9 m -141.35 177.81 3.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.249 -0.432 . . . . 61.020000000000003 111.138 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -177.81 -155.72 14.74 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.742 -0.742 . . . . 53.399999999999999 112.489 179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -102.93 154.92 18.73 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.903 0.382 . . . . 75.129999999999995 110.849 -179.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 82.2 m-20 -61.28 -73.12 0.1 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.169 -0.469 . . . . 72.340000000000003 110.896 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 43.8 p90 -162.09 -179.17 6.89 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.201 -0.454 . . . . 75.329999999999998 110.947 -179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 6.7 m -156.73 161.12 39.82 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 74.420000000000002 110.9 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 38.2 pt -100.64 146.97 8.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.165 -0.471 . . . . 64.040000000000006 111.141 179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 13.8 t0 -149.29 111.71 4.72 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 73.120000000000005 110.835 179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 70.8 m-85 -120.22 40.73 3.39 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 65.430000000000007 110.885 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . 0.469 HG22 ' O ' ' A' ' 558' ' ' VAL . 0.8 OUTLIER -81.01 158.96 24.96 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 71.230000000000004 111.142 -179.928 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -103.89 -83.44 1.7 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.778 -0.725 . . . . 51.530000000000001 112.466 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -129.31 155.45 20.8 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.745 -0.741 . . . . 63.299999999999997 112.51 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 25.0 m -127.25 108.65 11.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.835 0.35 . . . . 63.149999999999999 111.147 -179.881 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.622 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -95.41 129.99 42.37 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.239 -0.437 . . . . 74.450000000000003 111.151 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -118.24 113.32 21.33 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.244 -0.434 . . . . 74.420000000000002 110.936 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -94.38 110.33 22.11 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 71.120000000000005 111.115 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.503 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -130.51 143.6 50.86 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.213 -0.449 . . . . 75.549999999999997 110.933 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 26.6 ttp180 -94.1 126.77 39.52 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.228 -0.442 . . . . 73.230000000000004 110.894 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -127.02 170.95 11.77 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 74.420000000000002 111.141 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.5 mt-10 -61.21 160.42 22.92 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.666 0.746 . . . . 75.140000000000001 110.881 -179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -17.76 37.36 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.698 2.265 . . . . 52.119999999999997 112.303 -179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -73.02 -44.15 61.25 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.248 -0.433 . . . . 73.0 110.944 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.436 HG21 ' HG ' ' A' ' 548' ' ' LEU . 95.7 t -60.71 125.55 17.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 41.530000000000001 111.143 179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 55.4 mt-10 -123.48 176.68 6.04 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 71.420000000000002 110.862 -180.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 90.3 t -51.63 -49.24 35.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.13 -0.487 . . . . 73.5 111.096 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 7.0 tt0 -51.17 -40.27 58.26 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.178 -0.464 . . . . 73.519999999999996 110.911 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.3 m -72.96 -35.12 66.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.151 -0.477 . . . . 73.239999999999995 111.154 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.587 ' HB3' HD13 ' A' ' 512' ' ' ILE . 4.8 mt -67.46 -44.1 79.43 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.209 -0.451 . . . . 54.409999999999997 110.908 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -71.05 -46.13 62.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.465 . . . . 61.539999999999999 110.888 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -63.97 -33.21 75.22 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.199 -0.455 . . . . 71.420000000000002 110.907 -179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 52.5 t80 -73.98 -47.44 37.34 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.465 . . . . 73.420000000000002 110.835 -179.871 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 35.8 mt -59.6 -43.35 93.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 71.040000000000006 110.91 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 21.9 pt-20 -73.09 -37.76 66.64 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.169 -0.469 . . . . 71.530000000000001 110.92 179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -58.35 -49.04 78.64 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.119 -0.491 . . . . 65.25 110.871 -179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.693 ' NZ ' HD13 ' A' ' 543' ' ' LEU . 0.2 OUTLIER -68.2 -24.76 64.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.188 -0.46 . . . . 74.340000000000003 110.901 179.959 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.02 -17.98 19.34 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.754 -0.736 . . . . 73.040000000000006 112.475 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -61.54 160.28 26.81 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.66 0.743 . . . . 71.439999999999998 110.846 -179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 86.87 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.672 2.248 . . . . 72.319999999999993 112.32 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -108.89 -22.09 7.12 Favored Glycine 0 N--CA 1.451 -0.359 0 C-N-CA 120.745 -0.74 . . . . 74.230000000000004 112.494 179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 15.0 ptmm? -75.85 -40.79 54.05 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.727 0.299 . . . . 75.400000000000006 110.839 -179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -85.28 -29.45 24.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.262 -0.427 . . . . 74.200000000000003 110.887 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.632 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -62.77 173.8 1.22 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.176 -0.466 . . . . 64.019999999999996 111.078 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.5 t -127.05 117.04 46.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.420000000000002 111.152 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.587 HD13 ' HB3' ' A' ' 496' ' ' LEU . 62.1 mt -96.91 137.33 24.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.173 -0.467 . . . . 75.299999999999997 111.071 179.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -133.13 150.35 52.05 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.167 -0.47 . . . . 72.409999999999997 111.146 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -102.5 144.0 31.5 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.203 -0.453 . . . . 74.109999999999999 110.913 -179.978 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.5 t -138.62 108.95 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.195 -0.457 . . . . 71.200000000000003 111.136 179.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 28.6 tp60 -77.56 107.42 10.01 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.195 -0.457 . . . . 65.209999999999994 110.929 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.576 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -88.9 160.22 44.13 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.578 0.704 . . . . 72.430000000000007 111.103 179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.576 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.1 Cg_endo -69.71 74.54 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.68 2.254 . . . . 72.329999999999998 112.353 179.981 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.582 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.1 t -176.03 140.05 0.4 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 75.140000000000001 111.136 -179.944 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -99.95 26.31 6.49 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.204 -0.453 . . . . 62.450000000000003 111.096 179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.69 -34.02 3.49 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.236 -0.438 . . . . 73.219999999999999 111.1 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.582 ' O ' HG23 ' A' ' 519' ' ' THR . 12.0 m-85 -145.1 157.28 44.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.259 -0.428 . . . . 74.409999999999997 110.925 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -124.16 157.43 34.7 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.146 -0.479 . . . . 74.310000000000002 110.873 -179.967 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . 0.481 ' CD ' ' HB2' ' A' ' 517' ' ' ALA . 12.4 mt-10 -93.73 141.86 28.01 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.182 -0.463 . . . . 70.120000000000005 110.901 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.448 ' O ' HD23 ' A' ' 485' ' ' LEU . 83.6 m-85 -130.46 128.95 42.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 71.150000000000006 110.846 -179.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.622 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.6 OUTLIER -104.15 105.51 15.7 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.181 -0.463 . . . . 75.25 110.957 179.999 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.534 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.2 t -95.98 116.68 38.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.209 -0.45 . . . . 72.150000000000006 111.148 179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.588 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 5.7 tptm -94.74 107.41 19.42 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 65.409999999999997 110.896 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.632 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.4 mt -130.65 154.29 81.71 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.56 0.695 . . . . 70.310000000000002 110.939 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 162.14 43.25 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.646 2.231 . . . . 61.210000000000001 112.341 179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 108.83 2.17 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.682 2.254 . . . . 63.420000000000002 112.338 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.2 mt -109.41 -171.08 1.77 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.2 -0.454 . . . . 63.509999999999998 110.93 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -71.84 154.88 40.98 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 54.530000000000001 110.82 -179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -51.98 -46.08 64.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.096 -0.502 . . . . 71.209999999999994 110.875 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.85 -36.12 78.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 65.319999999999993 110.877 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -65.04 -54.35 31.61 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.137 -0.483 . . . . 72.239999999999995 110.888 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 43.0 mtt180 -57.16 -48.11 79.52 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.207 -0.451 . . . . 64.340000000000003 110.865 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.7 mt -63.8 -43.59 95.82 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.204 -0.453 . . . . 73.209999999999994 110.888 -179.971 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -62.92 -44.51 95.89 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.195 -0.457 . . . . 71.510000000000005 110.892 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.2 tp -62.35 -51.23 68.44 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.157 -0.474 . . . . 53.049999999999997 110.938 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -56.08 -49.66 73.18 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.177 -0.465 . . . . 74.310000000000002 110.919 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 12.3 mmm180 -57.93 -51.91 67.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.101 -0.5 . . . . 72.230000000000004 110.857 -179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . 0.693 HD13 ' NZ ' ' A' ' 503' ' ' LYS . 0.5 OUTLIER -52.88 -44.35 66.81 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.211 -0.45 . . . . 63.119999999999997 110.9 -179.967 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 9.0 m-85 -60.31 -56.74 17.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 72.030000000000001 110.84 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.18 -13.11 59.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 70.340000000000003 111.122 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.73 -58.31 3.25 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 60.439999999999998 110.816 -179.775 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -88.56 -52.17 5.31 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.166 -0.47 . . . . 75.140000000000001 110.828 -179.909 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.436 ' HG ' HG21 ' A' ' 491' ' ' VAL . 1.8 tp -67.76 -12.71 61.14 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.208 -0.451 . . . . 74.400000000000006 110.919 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp 56.65 23.36 7.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.187 -0.461 . . . . 75.219999999999999 110.904 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -71.2 -179.82 2.54 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.201 -0.454 . . . . 62.420000000000002 111.125 179.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 94.2 m -144.99 111.29 5.62 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.226 -0.443 . . . . 73.140000000000001 111.144 -179.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.4 t -53.23 122.81 3.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.222 -0.445 . . . . 75.310000000000002 111.158 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . 0.454 HD12 ' HG2' ' A' ' 524' ' ' GLU . 18.2 mt -101.28 -47.55 4.67 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.168 -0.469 . . . . 70.120000000000005 110.893 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -158.28 175.15 14.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.237 -0.438 . . . . 64.420000000000002 111.092 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 88.5 p -161.33 152.71 18.87 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.224 -0.443 . . . . 75.239999999999995 110.867 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -134.36 149.49 50.85 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.167 -0.47 . . . . 73.430000000000007 110.845 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 51.5 m -144.07 136.1 26.38 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.121 -0.49 . . . . 45.329999999999998 111.089 -179.923 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . 0.469 ' O ' HG22 ' A' ' 478' ' ' THR . 24.2 t -94.14 101.04 12.12 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.154 -0.476 . . . . 53.130000000000003 111.136 179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.321 0 C-N-CA 120.719 -0.753 . . . . 61.399999999999999 112.529 -179.995 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 27.5 mtt . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.786 0.327 . . . . 64.030000000000001 110.895 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 60.1 t -112.08 118.93 58.92 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.287 -0.415 . . . . 40.450000000000003 111.149 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -144.17 93.33 0.17 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.698 -0.763 . . . . 62.340000000000003 112.527 179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 21.7 m-85 -109.98 -68.8 0.9 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.824 0.345 . . . . 71.409999999999997 110.894 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -111.97 105.35 13.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.187 -0.46 . . . . 64.219999999999999 110.868 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 46.0 t80 -58.24 120.19 8.23 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 75.120000000000005 110.914 -179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 2.4 m -119.85 153.54 35.65 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.138 -0.483 . . . . 73.439999999999998 110.873 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . 0.529 HD12 ' HB2' ' A' ' 477' ' ' PHE . 22.4 pt -108.75 174.53 1.66 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.127 -0.488 . . . . 72.25 111.144 179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -81.11 -21.32 39.97 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.189 -0.46 . . . . 61.219999999999999 110.862 179.837 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.529 ' HB2' HD12 ' A' ' 475' ' ' ILE . 6.0 m-85 -74.16 99.34 3.36 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 64.310000000000002 110.881 -179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 9.8 t -141.65 153.28 44.61 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 62.530000000000001 111.139 -179.895 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 140.76 -68.33 0.48 Allowed Glycine 0 N--CA 1.452 -0.269 0 C-N-CA 120.693 -0.765 . . . . 44.350000000000001 112.435 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . 0.465 ' O ' HG23 ' A' ' 558' ' ' VAL . . . 166.23 149.88 6.11 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.742 -0.742 . . . . 74.099999999999994 112.481 -179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . 0.403 ' OG1' HG23 ' A' ' 557' ' ' THR . 95.6 m -130.04 112.59 13.61 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.792 0.33 . . . . 54.530000000000001 111.135 -179.82 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.529 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -94.95 143.89 26.11 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.204 -0.453 . . . . 64.430000000000007 111.085 179.857 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 23.9 m-85 -131.44 116.41 17.46 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.184 -0.462 . . . . 74.0 110.916 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.616 HG22 ' CD ' ' A' ' 524' ' ' GLU . 0.2 OUTLIER -98.1 112.48 24.42 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.124 -0.489 . . . . 55.310000000000002 111.13 -179.977 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.459 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -134.78 147.8 50.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.192 -0.458 . . . . 35.340000000000003 110.967 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.446 ' NH2' HG21 ' A' ' 519' ' ' THR . 6.8 ttt180 -93.17 136.23 33.63 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.2 -0.455 . . . . 65.340000000000003 110.883 179.998 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -139.67 161.86 36.5 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 54.530000000000001 111.105 179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . 0.572 ' HG2' HG23 ' A' ' 491' ' ' VAL . 5.2 pm0 -51.98 156.87 2.35 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.685 0.755 . . . . 73.439999999999998 110.879 -179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -8.82 24.57 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.65 2.234 . . . . 73.219999999999999 112.339 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -82.43 -42.4 18.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.236 -0.438 . . . . 75.349999999999994 110.881 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.572 HG23 ' HG2' ' A' ' 488' ' ' GLU . 97.7 t -64.16 124.09 18.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.155 -0.475 . . . . 51.219999999999999 111.14 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 10.0 mt-10 -120.55 177.42 5.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.203 -0.453 . . . . 74.219999999999999 110.865 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.683 HG13 ' HB ' ' A' ' 512' ' ' ILE . 47.7 t -51.46 -47.49 35.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.152 -0.476 . . . . 64.510000000000005 111.113 179.968 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 20.3 pt-20 -51.83 -41.65 61.95 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.184 -0.462 . . . . 72.230000000000004 110.852 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.9 m -70.79 -34.46 71.8 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.205 -0.452 . . . . 43.140000000000001 111.123 -179.889 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.555 HD13 ' CG2' ' A' ' 512' ' ' ILE . 2.6 mt -67.2 -45.42 76.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.183 -0.462 . . . . 73.239999999999995 110.9 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 -69.89 -45.42 67.68 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.21 -0.45 . . . . 72.25 110.83 179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 8.6 ptm180 -64.93 -31.94 73.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 72.049999999999997 110.9 -179.888 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . 0.505 ' HZ ' HD22 ' A' ' 543' ' ' LEU . 36.9 t80 -75.17 -43.24 53.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.181 -0.463 . . . . 73.310000000000002 110.868 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 51.0 mt -63.48 -43.96 95.78 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.465 . . . . 72.439999999999998 110.885 -179.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -71.71 -42.07 67.79 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.444 . . . . 71.209999999999994 110.9 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -57.89 -49.0 78.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.152 -0.476 . . . . 71.239999999999995 110.868 -179.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 45.8 mmtm -66.24 -23.98 66.51 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.185 -0.462 . . . . 72.209999999999994 110.896 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -18.67 18.73 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.706 -0.759 . . . . 74.540000000000006 112.472 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -67.52 160.25 73.42 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.682 0.753 . . . . 73.25 110.851 -179.815 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 101.7 0.94 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.671 2.247 . . . . 71.319999999999993 112.335 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -123.51 -33.06 0.84 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.719 -0.753 . . . . 41.409999999999997 112.496 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 20.5 pttt -61.52 -43.5 98.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.746 0.308 . . . . 73.129999999999995 110.911 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 7.3 pt-20 -83.38 -31.51 26.68 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.175 -0.466 . . . . 72.200000000000003 110.883 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.587 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -55.79 172.06 0.19 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.17 -0.468 . . . . 42.399999999999999 111.114 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.6 t -126.93 111.09 24.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 72.140000000000001 111.109 179.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.683 ' HB ' HG13 ' A' ' 493' ' ' VAL . 34.5 mt -92.28 142.45 13.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.15 -0.477 . . . . 52.439999999999998 111.147 179.875 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.53 134.83 36.13 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.184 -0.462 . . . . 74.349999999999994 111.157 179.963 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 20.5 mt-30 -91.52 142.76 27.3 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 62.520000000000003 110.883 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 61.7 t -138.15 108.27 4.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.189 -0.46 . . . . 70.040000000000006 111.168 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 21.0 tp60 -74.9 132.68 41.65 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.466 . . . . 73.109999999999999 110.919 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.577 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -116.1 160.3 36.11 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.593 0.711 . . . . 42.420000000000002 111.099 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.577 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.79 74.45 1.3 Allowed 'Trans proline' 0 C--O 1.232 0.216 0 C-N-CA 122.65 2.234 . . . . 64.209999999999994 112.358 -179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.446 HG21 ' NH2' ' A' ' 486' ' ' ARG . 3.0 t -179.83 141.77 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.254 -0.43 . . . . 64.140000000000001 111.16 -179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -101.04 29.02 4.87 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.215 -0.448 . . . . 73.450000000000003 111.142 179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.6 -34.66 3.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.215 -0.448 . . . . 71.230000000000004 111.084 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -146.38 166.09 27.38 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.229 -0.442 . . . . 71.400000000000006 110.929 -179.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 19.8 mtm-85 -136.83 160.92 37.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.144 -0.48 . . . . 72.409999999999997 110.873 -179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . 0.616 ' CD ' HG22 ' A' ' 484' ' ' THR . 6.8 tp10 -93.94 140.21 29.98 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.166 -0.47 . . . . 70.349999999999994 110.903 -179.943 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . . . . . . . . . 44.0 m-85 -130.8 132.42 45.25 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.115 -0.493 . . . . 73.439999999999998 110.907 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.614 HD23 HG23 ' A' ' 484' ' ' THR . 0.6 OUTLIER -112.99 107.05 15.44 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.15 -0.477 . . . . 73.230000000000004 110.904 -179.975 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.533 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.1 t -97.35 133.5 38.83 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.147 -0.479 . . . . 63.140000000000001 111.098 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.511 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 43.6 tttt -108.65 107.94 18.62 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.139 -0.482 . . . . 73.239999999999995 110.93 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.587 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -129.7 154.61 80.98 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.628 0.728 . . . . 75.120000000000005 110.89 179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.28 42.67 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.716 2.278 . . . . 50.5 112.306 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 110.95 2.67 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.679 2.252 . . . . 64.030000000000001 112.361 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.6 mt -114.28 -170.99 1.83 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.255 -0.429 . . . . 72.299999999999997 110.915 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.1 p -74.55 154.03 38.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.167 -0.47 . . . . 62.43 110.862 -179.909 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -51.92 -40.62 61.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.181 -0.463 . . . . 70.319999999999993 110.839 179.968 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 8.7 mm-40 -61.25 -42.88 99.38 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.2 -0.455 . . . . 73.420000000000002 110.926 -179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 15.9 mmm180 -63.34 -52.58 61.23 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.138 -0.483 . . . . 61.130000000000003 110.903 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 82.4 mtt180 -54.5 -52.95 60.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.189 -0.46 . . . . 62.32 110.845 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.9 mt -63.36 -36.18 82.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.179 -0.464 . . . . 54.549999999999997 110.913 -179.961 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -64.54 -49.84 69.68 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.2 -0.455 . . . . 72.010000000000005 110.903 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 21.7 tp -62.53 -51.0 69.12 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.111 -0.495 . . . . 75.439999999999998 110.975 -179.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 16.1 mt-10 -56.37 -47.71 78.33 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.163 -0.471 . . . . 70.530000000000001 110.891 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -59.87 -53.89 52.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.166 -0.47 . . . . 73.209999999999994 110.848 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . 0.505 HD22 ' HZ ' ' A' ' 499' ' ' PHE . 0.8 OUTLIER -52.66 -44.08 65.95 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.225 -0.443 . . . . 53.119999999999997 110.898 -179.964 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.26 -56.46 21.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.219 -0.446 . . . . 72.439999999999998 110.887 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.14 -13.37 60.05 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.122 -0.49 . . . . 75.400000000000006 111.16 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 20.0 t -79.57 -57.54 3.63 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.217 -0.447 . . . . 71.420000000000002 110.829 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 32.5 mt-10 -88.38 -52.26 5.29 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.109 -0.496 . . . . 75.140000000000001 110.899 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.498 HD21 HG11 ' A' ' 491' ' ' VAL . 1.2 tp -67.76 -12.46 60.61 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.111 -0.495 . . . . 62.039999999999999 110.952 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 23.1 mmtp 57.16 23.46 8.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.203 -0.453 . . . . 65.519999999999996 110.893 179.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.32 178.39 1.55 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.202 -0.454 . . . . 63.32 111.094 179.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 90.8 m -145.01 110.91 5.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 74.129999999999995 111.154 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 36.4 t -54.73 131.88 17.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.234 -0.439 . . . . 63.509999999999998 111.117 179.919 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 46.5 mt -115.18 -43.6 3.07 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.122 -0.49 . . . . 72.109999999999999 110.888 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -157.44 174.85 14.78 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 64.239999999999995 111.087 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 5.2 p -169.27 148.63 3.96 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.226 -0.443 . . . . 71.540000000000006 110.813 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -133.09 148.53 52.17 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.113 -0.494 . . . . 65.219999999999999 110.927 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . 0.403 HG23 ' OG1' ' A' ' 481' ' ' THR . 3.9 m -138.97 145.48 39.79 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.148 -0.478 . . . . 60.140000000000001 111.149 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . 0.465 HG23 ' O ' ' A' ' 480' ' ' GLY . 68.0 t -100.33 103.76 15.24 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 CA-C-N 116.228 -0.442 . . . . 53.439999999999998 111.162 179.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.32 0 C-N-CA 120.749 -0.739 . . . . 61.030000000000001 112.503 -179.99 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 17.7 ptt? . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.797 0.332 . . . . 74.329999999999998 110.921 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 16.7 m -133.99 169.57 21.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.246 -0.433 . . . . 75.340000000000003 111.146 179.94 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 91.41 59.94 1.33 Allowed Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.708 -0.758 . . . . 63.219999999999999 112.476 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 48.0 p90 -140.15 161.32 37.92 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.856 0.36 . . . . 73.120000000000005 110.864 -179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 9.0 p-10 -171.36 126.13 0.64 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.137 -0.483 . . . . 74.310000000000002 110.884 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 13.6 p90 -133.76 147.19 51.28 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.176 -0.465 . . . . 75.239999999999995 110.947 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 2.9 p -132.19 142.3 49.4 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.107 -0.497 . . . . 72.120000000000005 110.862 -179.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . 0.733 HG22 ' H ' ' A' ' 477' ' ' PHE . 26.7 mm -94.48 141.82 14.37 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.16 -0.473 . . . . 63.43 111.159 179.926 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -106.41 23.16 14.62 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.181 -0.463 . . . . 75.310000000000002 110.837 179.882 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.733 ' H ' HG22 ' A' ' 475' ' ' ILE . 7.1 t80 52.96 46.84 25.96 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 74.430000000000007 110.882 -179.909 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . 0.633 HG21 ' HG3' ' A' ' 531' ' ' PRO . 8.9 t -80.95 163.56 23.23 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.145 -0.48 . . . . 34.340000000000003 111.173 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -69.31 -54.54 12.91 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.72 -0.753 . . . . 54.340000000000003 112.475 179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 137.91 179.2 16.78 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.756 -0.735 . . . . 40.350000000000001 112.544 -179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 33.2 m -125.19 108.35 11.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.788 0.328 . . . . 73.310000000000002 111.116 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.518 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -96.75 125.22 41.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.253 -0.431 . . . . 74.209999999999994 111.073 179.852 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -114.82 112.36 22.66 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.216 -0.447 . . . . 73.109999999999999 110.929 -179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.493 HG23 ' CD2' ' A' ' 526' ' ' LEU . 0.6 OUTLIER -95.41 112.92 24.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 43.299999999999997 111.166 179.978 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.469 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -134.01 143.2 47.96 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.246 -0.434 . . . . 64.25 110.924 179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 24.4 ttp180 -89.27 142.58 27.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.248 -0.433 . . . . 71.400000000000006 110.842 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . 0.786 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -141.66 166.65 24.15 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.156 -0.475 . . . . 72.329999999999998 111.148 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 13.2 mt-10 -55.88 160.55 4.27 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.674 0.749 . . . . 73.349999999999994 110.876 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -17.67 37.19 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.632 2.222 . . . . 62.140000000000001 112.358 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 9.3 m120 -76.13 -40.45 52.73 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.249 -0.432 . . . . 71.340000000000003 110.955 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.466 HG11 HD21 ' A' ' 548' ' ' LEU . 82.7 t -59.22 137.33 21.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.154 -0.476 . . . . 72.219999999999999 111.091 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 15.6 mt-10 -133.65 175.65 9.25 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.161 -0.472 . . . . 60.229999999999997 110.904 179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 85.1 t -51.92 -47.76 40.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.18 -0.463 . . . . 61.420000000000002 111.146 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -54.12 -39.67 66.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.12 -0.491 . . . . 65.439999999999998 110.901 -179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 85.5 m -67.01 -43.13 83.69 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.177 -0.465 . . . . 74.310000000000002 111.143 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.698 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.4 mt -62.63 -51.08 68.67 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.209 -0.45 . . . . 73.129999999999995 110.927 179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -64.42 -36.28 83.64 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.142 -0.481 . . . . 74.120000000000005 110.897 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 61.2 mtt180 -63.95 -45.71 87.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.192 -0.458 . . . . 71.340000000000003 110.869 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 10.2 t80 -70.08 -36.13 74.7 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.178 -0.464 . . . . 74.420000000000002 110.856 -179.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.597 HD12 HD11 ' A' ' 512' ' ' ILE . 43.4 mt -62.89 -52.93 61.19 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.166 -0.47 . . . . 71.030000000000001 110.947 -179.956 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -68.71 -38.01 79.94 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.165 -0.471 . . . . 75.319999999999993 110.852 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.88 -47.51 84.67 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.172 -0.467 . . . . 73.549999999999997 110.934 -179.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 62.6 mmtt -67.82 -25.08 65.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.1 -0.5 . . . . 74.540000000000006 110.908 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 113.96 -18.28 19.23 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.754 -0.736 . . . . 71.010000000000005 112.505 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 17.8 m-85 -62.96 160.28 39.4 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.655 0.74 . . . . 72.430000000000007 110.867 -179.888 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.8 91.31 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.666 2.244 . . . . 65.420000000000002 112.303 -179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -108.76 -30.17 3.84 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.733 -0.746 . . . . 70.420000000000002 112.518 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 42.5 mttm -62.73 -51.96 65.13 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.768 0.318 . . . . 71.099999999999994 110.908 -179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -75.37 -29.89 60.02 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.19 -0.459 . . . . 72.239999999999995 110.918 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.618 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -57.43 168.66 0.75 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.116 -0.493 . . . . 50.539999999999999 111.119 179.953 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.01 111.13 24.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.224 -0.444 . . . . 72.200000000000003 111.109 179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.698 HD13 ' HB3' ' A' ' 496' ' ' LEU . 53.8 mt -99.47 134.66 37.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.158 -0.474 . . . . 74.140000000000001 111.14 179.877 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 4.0 m -134.68 155.24 50.88 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.182 -0.463 . . . . 70.030000000000001 111.105 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 2.0 pm0 -102.85 143.99 31.75 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 74.030000000000001 110.922 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . 0.529 HG11 ' OE2' ' A' ' 524' ' ' GLU . 91.0 t -136.96 127.01 39.11 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 75.140000000000001 111.115 179.968 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 9.3 tp-100 -80.98 99.13 8.26 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.179 -0.464 . . . . 74.140000000000001 110.899 -179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.573 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -79.62 160.26 70.05 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.573 0.701 . . . . 54.109999999999999 111.081 179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.573 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.2 Cg_endo -69.7 74.47 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.195 0 C-N-CA 122.681 2.254 . . . . 73.409999999999997 112.365 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.561 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.1 t -177.32 139.23 0.25 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.274 -0.421 . . . . 73.420000000000002 111.151 -179.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.0 24.98 6.42 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 50.329999999999998 111.105 179.868 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.19 -35.49 2.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 60.32 111.082 179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.561 ' O ' HG23 ' A' ' 519' ' ' THR . 7.9 m-85 -136.83 161.41 36.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 72.510000000000005 110.891 -179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -123.75 155.56 37.66 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.116 -0.493 . . . . 72.400000000000006 110.895 179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . 0.529 ' OE2' HG11 ' A' ' 515' ' ' VAL . 33.2 tt0 -90.55 144.46 25.75 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.193 -0.458 . . . . 72.019999999999996 110.887 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.786 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 90.4 m-85 -130.2 124.55 32.81 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.144 -0.48 . . . . 74.400000000000006 110.866 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.518 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -101.14 105.09 16.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.114 -0.494 . . . . 64.409999999999997 110.926 179.987 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.538 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.02 123.81 48.41 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.235 -0.439 . . . . 71.540000000000006 111.096 179.872 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.53 ' O ' HD23 ' A' ' 529' ' ' LEU . 18.2 tttp -102.68 108.56 19.86 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.196 -0.456 . . . . 73.540000000000006 110.904 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.618 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.4 mt -132.06 154.45 81.69 Favored Pre-proline 0 C--N 1.328 -0.349 0 CA-C-O 121.622 0.725 . . . . 74.519999999999996 110.89 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 162.14 43.2 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.682 2.254 . . . . 64.430000000000007 112.333 179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . 0.633 ' HG3' HG21 ' A' ' 478' ' ' THR . 53.7 Cg_endo -69.81 107.28 1.83 Allowed 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.676 2.251 . . . . 62.549999999999997 112.362 179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 5.1 mt -109.85 -171.03 1.76 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.235 -0.439 . . . . 72.099999999999994 110.928 -179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -72.01 153.69 41.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.44 . . . . 74.239999999999995 110.871 -179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 13.7 t0 -52.09 -45.86 65.01 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.146 -0.479 . . . . 74.030000000000001 110.867 179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -60.05 -37.46 79.89 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.176 -0.466 . . . . 73.310000000000002 110.903 -179.883 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 16.4 mmm180 -65.65 -57.47 8.03 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.132 -0.486 . . . . 72.0 110.849 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 70.5 mtm180 -53.25 -46.43 69.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.231 -0.44 . . . . 74.319999999999993 110.892 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -67.02 -38.8 86.59 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.174 -0.466 . . . . 73.430000000000007 110.96 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -64.08 -46.4 84.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.182 -0.463 . . . . 75.349999999999994 110.887 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 26.0 tp -65.12 -51.06 63.5 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.145 -0.48 . . . . 75.540000000000006 110.911 -179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 6.1 mt-10 -58.34 -49.05 78.59 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.183 -0.462 . . . . 73.200000000000003 110.896 179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 37.4 mtm180 -58.76 -53.73 55.1 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 72.540000000000006 110.872 -179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.1 mt -52.75 -43.66 65.91 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.207 -0.451 . . . . 44.329999999999998 110.894 -179.944 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.31 -56.39 22.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 64.319999999999993 110.898 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.58 -13.23 60.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.138 -0.483 . . . . 61.409999999999997 111.091 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 17.6 t -79.55 -56.84 4.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 64.019999999999996 110.873 -179.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -88.37 -52.16 5.35 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.135 -0.484 . . . . 73.409999999999997 110.91 -179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.466 HD21 HG11 ' A' ' 491' ' ' VAL . 1.0 OUTLIER -67.96 -12.17 60.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.12 -0.491 . . . . 63.409999999999997 110.905 -179.97 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt 57.57 23.46 9.28 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.197 -0.456 . . . . 72.239999999999995 110.877 179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -64.58 -179.55 0.5 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.258 -0.428 . . . . 53.439999999999998 111.1 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 90.5 m -144.71 110.88 5.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 72.510000000000005 111.188 -179.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.8 t -57.04 118.87 2.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.247 -0.433 . . . . 72.030000000000001 111.172 179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 55.8 mt -99.75 -47.7 4.97 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.194 -0.457 . . . . 73.010000000000005 110.874 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.53 173.45 16.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 71.510000000000005 111.106 179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 6.1 p -165.49 149.95 8.62 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 74.25 110.85 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 61.8 mm-40 -137.65 144.8 42.04 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.1 -0.5 . . . . 73.099999999999994 110.904 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 44.4 m -143.54 147.14 34.01 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.129 -0.487 . . . . 63.409999999999997 111.142 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 21.9 t -115.09 123.16 70.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.255 -0.43 . . . . 72.329999999999998 111.074 179.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 32.409999999999997 112.503 179.991 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.86 0.362 . . . . 74.25 110.87 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 12.3 m -53.96 156.78 0.72 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.185 -0.461 . . . . 61.530000000000001 111.145 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 167.13 -99.86 0.16 Allowed Glycine 0 N--CA 1.452 -0.278 0 C-N-CA 120.739 -0.744 . . . . 51.030000000000001 112.488 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -78.89 136.4 37.28 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.849 0.357 . . . . 75.25 110.916 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 32.6 t-20 -95.32 121.7 37.25 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.131 -0.486 . . . . 44.240000000000002 110.906 -179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 41.9 p90 -140.76 154.32 46.24 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.212 -0.449 . . . . 74.219999999999999 110.928 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 22.1 t -167.63 172.71 9.12 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.114 -0.494 . . . . 63.310000000000002 110.874 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 2.7 pp -126.83 161.83 32.71 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.174 -0.467 . . . . 75.519999999999996 111.131 179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . 0.575 ' OD1' HG22 ' A' ' 478' ' ' THR . 0.0 OUTLIER -106.32 -21.77 13.01 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 42.310000000000002 110.909 179.801 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 13.0 t80 62.0 28.43 17.24 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.168 -0.469 . . . . 73.230000000000004 110.847 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . 0.575 HG22 ' OD1' ' A' ' 476' ' ' ASP . 11.8 t -98.53 30.32 3.29 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.17 -0.468 . . . . 65.140000000000001 111.108 -179.878 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 175.43 -100.62 0.15 Allowed Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.751 -0.737 . . . . 61.219999999999999 112.513 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 137.55 171.38 12.17 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.704 -0.76 . . . . 72.140000000000001 112.482 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . 0.409 HG23 ' O ' ' A' ' 556' ' ' GLU . 7.1 m -122.84 107.54 11.99 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.776 0.322 . . . . 62.32 111.141 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.3 130.09 42.19 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.214 -0.448 . . . . 54.119999999999997 111.128 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 16.0 m-85 -120.32 110.53 16.67 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.279 -0.419 . . . . 74.5 110.902 -179.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.8 m -94.26 111.35 23.08 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.163 -0.471 . . . . 74.340000000000003 111.18 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.495 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -130.31 143.16 50.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.177 -0.465 . . . . 70.329999999999998 110.962 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.516 ' HB2' HD11 ' A' ' 553' ' ' LEU . 12.1 ttt180 -89.67 148.02 23.55 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.235 -0.438 . . . . 73.510000000000005 110.828 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . 0.737 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -153.35 169.64 22.61 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.182 -0.463 . . . . 74.239999999999995 111.102 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -62.6 160.54 34.06 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.646 0.736 . . . . 63.340000000000003 110.9 -179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 -17.6 37.37 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.67 2.247 . . . . 65.340000000000003 112.358 179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 38.8 m-20 -69.18 -45.73 69.24 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.204 -0.453 . . . . 72.430000000000007 110.913 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.522 HG11 HD21 ' A' ' 548' ' ' LEU . 42.7 t -65.22 129.56 29.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 71.219999999999999 111.127 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -124.16 177.29 5.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.148 -0.478 . . . . 73.209999999999994 110.886 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.458 HG13 ' HB ' ' A' ' 512' ' ' ILE . 93.8 t -51.7 -48.07 37.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 71.310000000000002 111.137 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 20.7 pt-20 -52.02 -41.05 61.95 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.168 -0.469 . . . . 74.450000000000003 110.899 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 95.4 m -68.95 -39.55 79.45 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 62.020000000000003 111.145 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.743 ' HB3' HD13 ' A' ' 512' ' ' ILE . 10.2 mt -64.03 -51.08 65.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.193 -0.458 . . . . 54.420000000000002 110.916 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 9.6 ptm180 -65.09 -40.95 95.32 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.192 -0.458 . . . . 75.430000000000007 110.85 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 62.1 mtp180 -61.34 -43.27 99.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 64.420000000000002 110.828 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -70.51 -37.75 74.18 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 73.319999999999993 110.932 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.569 HD12 HD11 ' A' ' 512' ' ' ILE . 33.9 mt -61.33 -51.82 67.25 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.136 -0.484 . . . . 71.129999999999995 110.89 -179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -69.62 -37.98 77.06 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.269 -0.423 . . . . 74.409999999999997 110.879 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -57.39 -48.96 77.71 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.134 -0.485 . . . . 61.310000000000002 110.897 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.666 ' NZ ' HD22 ' A' ' 543' ' ' LEU . 17.2 mmtp -67.36 -24.05 65.67 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.191 -0.459 . . . . 63.030000000000001 110.89 179.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.1 -18.3 18.85 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.725 -0.75 . . . . 53.149999999999999 112.473 179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.406 ' CD2' HD22 ' A' ' 540' ' ' LEU . 18.5 m-85 -64.54 160.21 53.98 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.682 0.753 . . . . 73.439999999999998 110.844 -179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 96.06 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.689 2.259 . . . . 63.030000000000001 112.357 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -113.76 -41.23 0.94 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.746 -0.74 . . . . 75.219999999999999 112.506 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.05 -40.28 84.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.71 0.291 . . . . 74.439999999999998 110.877 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -83.75 -26.37 29.75 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 73.209999999999994 110.896 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.614 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -66.28 173.17 3.35 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.151 -0.477 . . . . 62.549999999999997 111.108 179.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.02 113.01 30.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.192 -0.458 . . . . 74.420000000000002 111.129 179.954 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.743 HD13 ' HB3' ' A' ' 496' ' ' LEU . 46.6 mt -102.29 132.96 47.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.171 -0.468 . . . . 62.229999999999997 111.096 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -127.76 141.77 51.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.14 -0.482 . . . . 71.239999999999995 111.154 179.949 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 17.6 tt0 -92.92 126.15 37.86 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.266 -0.424 . . . . 74.140000000000001 110.921 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 92.8 t -116.35 99.22 7.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.267 0 CA-C-N 116.187 -0.461 . . . . 62.229999999999997 111.118 179.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -73.24 113.71 10.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.177 -0.465 . . . . 64.340000000000003 110.892 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -94.3 160.31 32.17 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.588 0.709 . . . . 63.43 111.091 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.2 Cg_endo -69.82 74.53 1.31 Allowed 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.687 2.258 . . . . 63.100000000000001 112.305 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.5 t -177.0 137.17 0.23 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.194 -0.457 . . . . 52.340000000000003 111.171 -179.976 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.77 28.1 3.21 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.228 -0.442 . . . . 74.400000000000006 111.116 179.836 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.43 -34.66 3.23 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.232 -0.44 . . . . 73.420000000000002 111.06 179.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.544 ' O ' HG23 ' A' ' 519' ' ' THR . 15.4 m-85 -147.97 166.37 27.92 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.284 -0.417 . . . . 54.310000000000002 110.872 -179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 13.0 mtm180 -140.35 159.67 41.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.102 -0.499 . . . . 71.530000000000001 110.868 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . 0.424 ' HG2' HD12 ' A' ' 553' ' ' LEU . 9.3 mt-10 -93.24 141.47 28.39 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.124 -0.489 . . . . 34.43 110.881 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.737 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 94.4 m-85 -127.31 124.34 38.48 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.139 -0.482 . . . . 73.319999999999993 110.869 -179.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -101.23 111.58 23.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.121 -0.491 . . . . 71.099999999999994 110.936 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.557 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.5 t -104.17 117.0 49.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.205 -0.452 . . . . 64.129999999999995 111.094 179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.56 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 5.3 ttmm -97.87 109.3 22.08 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 110.899 179.89 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.614 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.5 mt -131.71 154.38 81.78 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.657 0.741 . . . . 72.25 110.893 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 162.17 43.11 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.661 2.241 . . . . 72.430000000000007 112.352 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 105.28 1.47 Allowed 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.648 2.232 . . . . 73.299999999999997 112.361 179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 4.7 mt -107.32 -171.06 1.8 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.218 -0.446 . . . . 74.099999999999994 110.937 -179.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 46.4 t -71.18 151.24 44.57 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.214 -0.448 . . . . 52.509999999999998 110.862 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.93 -47.54 64.65 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 75.540000000000006 110.877 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -58.38 -41.05 83.97 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.162 -0.472 . . . . 73.120000000000005 110.913 -179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 21.5 mmt85 -64.44 -53.32 50.12 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.485 . . . . 61.229999999999997 110.894 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 8.9 mtt85 -53.28 -52.99 57.29 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.461 . . . . 73.129999999999995 110.908 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.2 mt -63.85 -34.42 77.89 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.183 -0.462 . . . . 73.430000000000007 110.894 179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 15.4 tp10 -65.86 -46.79 77.15 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 73.030000000000001 110.9 179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.406 HD22 ' CD2' ' A' ' 505' ' ' PHE . 26.3 tp -64.86 -51.09 63.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.133 -0.485 . . . . 75.310000000000002 110.913 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -56.68 -49.39 75.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.2 -0.455 . . . . 55.43 110.885 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 8.6 mmt85 -58.0 -53.41 58.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.185 -0.462 . . . . 74.5 110.898 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . 0.666 HD22 ' NZ ' ' A' ' 503' ' ' LYS . 9.3 mt -52.79 -43.27 65.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.21 -0.45 . . . . 71.099999999999994 110.912 -179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.55 -56.51 20.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.19 -0.459 . . . . 72.019999999999996 110.88 179.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.58 -13.23 60.78 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.119 -0.492 . . . . 61.25 111.073 179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 23.2 t -79.55 -56.96 3.93 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.246 -0.434 . . . . 74.049999999999997 110.87 -179.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -88.33 -52.2 5.33 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.108 -0.496 . . . . 64.140000000000001 110.875 -179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.522 HD21 HG11 ' A' ' 491' ' ' VAL . 1.9 tp -67.9 -12.28 60.37 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.129 -0.487 . . . . 70.439999999999998 110.893 -179.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 25.8 mmmt 57.58 23.32 9.13 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.159 -0.473 . . . . 73.109999999999999 110.903 179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -65.3 -179.73 0.64 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.24 -0.437 . . . . 60.340000000000003 111.092 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 86.2 m -145.12 110.94 5.43 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.2 -0.454 . . . . 74.099999999999994 111.146 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 62.1 t -57.59 126.76 15.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.212 -0.449 . . . . 75.430000000000007 111.122 179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . 0.516 HD11 ' HB2' ' A' ' 486' ' ' ARG . 82.5 mt -110.72 -48.21 3.16 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.168 -0.469 . . . . 71.530000000000001 110.923 179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -144.27 168.89 18.99 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.163 -0.471 . . . . 61.329999999999998 111.133 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 84.5 p -169.48 143.67 2.85 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.237 -0.438 . . . . 55.039999999999999 110.893 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.409 ' O ' HG23 ' A' ' 481' ' ' THR . 18.9 mt-10 -136.38 143.23 43.91 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.1 -0.5 . . . . 64.329999999999998 110.883 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 44.8 m -135.66 146.55 47.93 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.137 -0.483 . . . . 71.409999999999997 111.131 -179.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 35.8 t -121.77 97.0 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.455 . . . . 55.229999999999997 111.158 179.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.31 0 C-N-CA 120.734 -0.746 . . . . 65.200000000000003 112.499 179.982 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 9.7 mtm . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.813 0.339 . . . . 71.109999999999999 110.887 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 34.9 m -121.9 160.12 23.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.207 -0.451 . . . . 44.32 111.156 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -103.48 -168.94 25.64 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.728 -0.749 . . . . 72.129999999999995 112.469 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -164.36 132.72 3.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.865 0.364 . . . . 75.129999999999995 110.866 -179.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 3.1 t-20 -171.09 153.5 3.77 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 55.340000000000003 110.861 -179.937 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 51.1 p90 -167.67 145.9 4.65 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.152 -0.476 . . . . 75.329999999999998 110.943 -179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 84.6 p -168.81 131.2 1.3 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.142 -0.481 . . . . 74.430000000000007 110.888 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -123.44 154.22 29.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.14 -0.482 . . . . 64.340000000000003 111.138 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 4.3 t0 -161.72 110.45 1.5 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.154 -0.475 . . . . 62.439999999999998 110.858 179.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 70.5 t80 -55.19 102.63 0.07 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.201 -0.454 . . . . 75.230000000000004 110.857 -179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 12.0 t -148.76 166.21 29.1 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.114 -0.494 . . . . 71.439999999999998 111.148 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . 0.588 ' HA3' HG21 ' A' ' 558' ' ' VAL . . . -68.7 -60.36 5.42 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.77 -0.729 . . . . 52.350000000000001 112.51 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 133.72 161.41 9.68 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.731 -0.747 . . . . 51.399999999999999 112.47 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . 0.625 ' OG1' HG23 ' A' ' 557' ' ' THR . 93.2 m -119.4 113.35 20.66 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.82 0.343 . . . . 74.439999999999998 111.161 -179.853 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.715 ' HB1' HD11 ' A' ' 526' ' ' LEU . . . -98.2 123.2 42.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.226 -0.443 . . . . 64.340000000000003 111.127 179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -111.48 112.35 24.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 71.340000000000003 110.92 -179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.501 HG23 HD22 ' A' ' 526' ' ' LEU . 0.8 OUTLIER -96.45 111.48 23.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.112 -0.495 . . . . 75.030000000000001 111.144 -179.96 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.485 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -130.04 142.93 50.56 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.243 -0.435 . . . . 75.230000000000004 110.945 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -94.6 135.79 35.66 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.214 -0.448 . . . . 61.009999999999998 110.863 179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -144.37 170.88 15.17 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.166 -0.47 . . . . 60.310000000000002 111.044 179.961 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -62.32 160.55 31.68 Favored Pre-proline 0 C--N 1.33 -0.257 0 CA-C-O 121.671 0.748 . . . . 74.209999999999994 110.87 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -19.7 35.76 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.717 2.278 . . . . 64.230000000000004 112.337 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -64.99 -46.85 79.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.219 -0.446 . . . . 75.319999999999993 110.904 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.404 HG11 HD21 ' A' ' 548' ' ' LEU . 54.1 t -64.32 121.79 14.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.203 -0.453 . . . . 73.420000000000002 111.122 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -117.28 177.26 4.79 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.213 -0.449 . . . . 54.100000000000001 110.91 179.973 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 83.3 t -52.15 -48.47 42.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.153 -0.476 . . . . 74.420000000000002 111.153 179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -52.35 -43.88 64.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.444 . . . . 62.329999999999998 110.87 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 38.6 m -66.84 -41.96 86.56 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.143 -0.48 . . . . 74.25 111.171 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.778 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.7 mt -63.57 -50.88 67.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 72.400000000000006 110.956 179.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 27.6 ptt180 -64.64 -35.96 82.71 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.168 -0.469 . . . . 65.120000000000005 110.89 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 41.2 mtt180 -64.7 -45.57 86.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.169 -0.469 . . . . 61.130000000000003 110.843 -179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -70.03 -35.98 74.71 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.183 -0.462 . . . . 74.409999999999997 110.902 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.84 HD12 HD11 ' A' ' 512' ' ' ILE . 26.4 mt -63.6 -52.79 59.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.12 -0.491 . . . . 74.5 110.929 -179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -68.23 -38.0 81.42 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.243 -0.435 . . . . 64.439999999999998 110.891 179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -60.22 -45.76 92.1 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.17 -0.468 . . . . 71.400000000000006 110.868 -179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 35.4 mmtt -68.57 -23.68 64.52 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.162 -0.472 . . . . 75.010000000000005 110.87 179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.08 -19.07 18.24 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.694 -0.765 . . . . 22.510000000000002 112.475 179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.546 ' CD2' HD22 ' A' ' 540' ' ' LEU . 15.5 m-85 -64.7 160.24 55.16 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.648 0.737 . . . . 70.099999999999994 110.86 -179.84 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 97.43 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.705 2.27 . . . . 71.430000000000007 112.34 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -111.56 -35.03 1.96 Allowed Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.728 -0.749 . . . . 72.510000000000005 112.474 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 47.1 mttp -64.66 -51.88 60.21 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.736 0.303 . . . . 73.530000000000001 110.906 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 9.9 mt-10 -71.66 -33.24 68.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 63.409999999999997 110.851 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.651 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -64.44 170.83 3.58 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.169 -0.469 . . . . 72.400000000000006 111.082 179.945 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.8 t -127.0 111.67 26.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.212 -0.449 . . . . 52.219999999999999 111.162 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.84 HD11 HD12 ' A' ' 500' ' ' LEU . 44.4 mt -97.53 119.89 46.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.194 -0.457 . . . . 72.319999999999993 111.164 179.903 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -115.24 155.43 27.24 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 73.239999999999995 111.128 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -114.71 142.24 46.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 54.32 110.902 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 61.8 t -134.55 113.42 16.82 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 72.209999999999994 111.156 179.949 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -69.19 102.18 1.63 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.135 -0.484 . . . . 70.340000000000003 110.887 -179.939 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.578 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -74.0 160.27 82.15 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.616 0.722 . . . . 71.120000000000005 111.091 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.578 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.83 74.6 1.31 Allowed 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.661 2.241 . . . . 75.420000000000002 112.335 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 2.1 t 179.59 141.45 0.13 Allowed 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.19 -0.459 . . . . 60.439999999999998 111.14 -179.991 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -96.03 26.64 4.04 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.238 -0.437 . . . . 53.549999999999997 111.095 179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.56 -35.06 3.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.22 -0.446 . . . . 71.439999999999998 111.083 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -140.03 178.57 7.17 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.231 -0.441 . . . . 70.150000000000006 110.91 -179.821 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 47.8 mtm180 -149.73 157.23 43.02 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.125 -0.489 . . . . 72.209999999999994 110.875 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -94.1 152.65 18.61 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.444 . . . . 73.239999999999995 110.875 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.465 ' O ' HD23 ' A' ' 485' ' ' LEU . 80.7 m-85 -139.76 129.72 24.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.125 -0.489 . . . . 63.439999999999998 110.873 -179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.715 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -103.41 109.01 20.48 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.186 -0.461 . . . . 74.239999999999995 110.944 179.973 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.522 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.09 115.47 35.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.149 -0.478 . . . . 71.510000000000005 111.137 179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.582 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 30.1 tttm -94.97 107.44 19.47 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.158 -0.474 . . . . 63.240000000000002 110.895 179.935 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.651 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -132.36 154.29 81.53 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.625 0.726 . . . . 72.310000000000002 110.934 179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 162.12 43.31 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.704 2.269 . . . . 64.420000000000002 112.35 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.83 104.16 1.29 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.664 2.243 . . . . 72.239999999999995 112.326 179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.2 mt -104.36 -171.3 1.9 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.208 -0.451 . . . . 73.049999999999997 110.943 179.95 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 30.5 m -70.24 150.87 45.97 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.194 -0.457 . . . . 72.219999999999999 110.841 -179.928 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -52.29 -47.32 65.97 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 61.240000000000002 110.858 179.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 43.8 mm-40 -60.91 -49.95 75.4 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.227 -0.442 . . . . 45.210000000000001 110.878 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 29.0 mmt180 -55.24 -55.5 30.67 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.148 -0.478 . . . . 71.140000000000001 110.834 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 71.8 mtp180 -53.2 -52.99 57.07 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.174 -0.467 . . . . 72.439999999999998 110.894 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.87 -35.2 72.59 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.191 -0.459 . . . . 74.319999999999993 110.907 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -65.92 -45.63 81.2 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.166 -0.47 . . . . 71.510000000000005 110.868 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.546 HD22 ' CD2' ' A' ' 505' ' ' PHE . 22.8 tp -63.38 -51.07 67.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.114 -0.494 . . . . 73.129999999999995 110.912 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 15.8 mt-10 -57.36 -50.02 74.29 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.217 -0.447 . . . . 75.209999999999994 110.893 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 14.8 mtm180 -57.96 -53.5 57.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.174 -0.467 . . . . 65.129999999999995 110.853 -179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . 0.46 HD23 ' O ' ' A' ' 543' ' ' LEU . 2.0 tt -52.68 -43.23 65.44 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 71.109999999999999 110.898 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.9 m-85 -60.66 -56.54 20.06 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 73.439999999999998 110.876 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.36 -13.32 60.44 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.159 -0.473 . . . . 63.32 111.09 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 25.1 t -79.64 -57.29 3.75 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.217 -0.447 . . . . 62.310000000000002 110.85 -179.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 45.7 mm-40 -88.33 -52.29 5.28 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.129 -0.487 . . . . 52.119999999999997 110.912 -179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.404 HD21 HG11 ' A' ' 491' ' ' VAL . 0.4 OUTLIER -67.77 -12.44 60.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.107 -0.497 . . . . 72.450000000000003 110.966 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 8.3 mmmm 57.49 23.26 8.92 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.185 -0.461 . . . . 62.109999999999999 110.882 179.812 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -67.29 178.7 1.43 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.254 -0.43 . . . . 63.219999999999999 111.142 179.814 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 42.4 m -143.89 110.98 5.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.244 -0.434 . . . . 55.119999999999997 111.144 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 59.9 t -58.18 104.01 0.13 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 74.219999999999999 111.145 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 25.1 mt -81.49 -39.08 25.31 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.198 -0.455 . . . . 71.209999999999994 110.926 179.982 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.59 173.2 13.3 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.197 -0.456 . . . . 74.450000000000003 111.083 179.775 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 1.3 t -166.06 155.81 12.12 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.194 -0.457 . . . . 72.040000000000006 110.87 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.566 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 7.0 pt-20 -149.55 141.69 24.01 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.47 . . . . 64.219999999999999 110.884 -179.972 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . 0.625 HG23 ' OG1' ' A' ' 481' ' ' THR . 27.7 m -141.31 145.72 35.83 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 74.040000000000006 111.151 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . 0.588 HG21 ' HA3' ' A' ' 479' ' ' GLY . 24.1 t -98.82 109.69 24.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 64.239999999999995 111.129 179.876 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.285 0 C-N-CA 120.721 -0.752 . . . . 50.450000000000003 112.472 179.946 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 23.2 mtt . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.784 0.326 . . . . 62.32 110.897 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 22.5 m -116.98 139.86 42.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.205 -0.452 . . . . 72.510000000000005 111.133 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 136.85 -106.0 0.53 Allowed Glycine 0 N--CA 1.452 -0.268 0 C-N-CA 120.695 -0.764 . . . . 74.5 112.472 179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 26.7 m-85 55.02 31.73 16.72 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 120.901 0.381 . . . . 74.129999999999995 110.895 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 48.6 m-80 -111.71 62.94 0.62 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.152 -0.476 . . . . 73.319999999999993 110.913 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 14.4 m-85 -115.14 104.57 11.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.135 -0.484 . . . . 73.409999999999997 110.898 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 5.2 m -129.36 125.26 36.26 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.103 -0.499 . . . . 71.030000000000001 110.87 -179.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 62.9 mt -96.18 145.28 8.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.16 -0.473 . . . . 72.349999999999994 111.122 179.955 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 19.7 t70 -114.87 -21.7 9.99 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.132 -0.485 . . . . 74.510000000000005 110.897 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.489 ' CD2' HG22 ' A' ' 478' ' ' THR . 27.2 t80 -122.28 -72.28 0.69 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.117 -0.492 . . . . 74.329999999999998 110.846 -179.874 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . 0.489 HG22 ' CD2' ' A' ' 477' ' ' PHE . 14.6 t -161.92 173.37 14.58 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 72.209999999999994 111.113 -179.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 145.86 110.21 0.65 Allowed Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.706 -0.759 . . . . 43.420000000000002 112.465 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -135.36 160.85 24.56 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.759 -0.734 . . . . 51.420000000000002 112.503 -179.905 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 92.1 m -122.04 110.72 16.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.8 0.333 . . . . 73.340000000000003 111.168 -179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.836 ' HB1' HD21 ' A' ' 526' ' ' LEU . . . -94.6 142.6 27.26 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.257 -0.429 . . . . 70.420000000000002 111.069 179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 28.1 m-85 -133.89 108.92 8.71 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.2 -0.455 . . . . 72.409999999999997 110.899 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.58 ' OG1' HD23 ' A' ' 526' ' ' LEU . 2.5 m -93.96 119.19 32.52 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.083 -0.508 . . . . 72.510000000000005 111.185 179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.426 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.3 pt? -131.3 156.55 45.26 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.216 -0.447 . . . . 74.150000000000006 110.93 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 4.2 ttm180 -106.17 150.07 26.2 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 71.519999999999996 110.839 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -157.31 171.69 19.95 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.144 -0.48 . . . . 51.32 111.088 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.4 mt-10 -65.24 160.6 56.57 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.653 0.739 . . . . 72.420000000000002 110.881 -179.936 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 -15.23 36.72 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.663 2.242 . . . . 53.219999999999999 112.338 -179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -62.82 -50.74 69.77 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.219 -0.446 . . . . 72.430000000000007 110.872 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 39.0 t -59.36 148.64 6.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.186 -0.461 . . . . 43.32 111.112 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -137.32 172.97 12.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.484 . . . . 73.450000000000003 110.875 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.429 HG22 ' HE2' ' A' ' 525' ' ' PHE . 87.2 t -51.41 -50.01 29.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.127 -0.488 . . . . 64.140000000000001 111.1 -179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -53.27 -40.39 64.63 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.205 -0.452 . . . . 73.439999999999998 110.918 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.4 m -68.36 -41.4 80.69 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.12 -0.491 . . . . 53.210000000000001 111.106 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.668 ' HB3' HD13 ' A' ' 512' ' ' ILE . 6.6 mt -60.51 -51.24 70.29 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.243 -0.435 . . . . 72.120000000000005 110.921 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.0 ptt85 -64.73 -42.95 94.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.198 -0.456 . . . . 74.409999999999997 110.902 179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 41.0 mtp180 -59.85 -38.05 81.01 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.466 . . . . 75.25 110.835 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . 0.522 ' HE1' HD22 ' A' ' 543' ' ' LEU . 9.4 t80 -72.04 -44.61 63.1 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.216 -0.447 . . . . 73.129999999999995 110.863 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 40.1 mt -57.02 -48.89 77.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.18 -0.464 . . . . 72.129999999999995 110.939 -179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.7 pp20? -71.5 -37.99 71.19 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.175 -0.466 . . . . 75.140000000000001 110.88 179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -55.28 -49.19 72.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 64.030000000000001 110.868 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -66.35 -25.92 67.04 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.169 -0.468 . . . . 61.340000000000003 110.939 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 112.44 -7.29 26.5 Favored Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.748 -0.739 . . . . 62.210000000000001 112.495 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.615 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.6 m-85 -71.45 160.31 82.95 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.656 0.741 . . . . 54.100000000000001 110.87 -179.841 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . 0.514 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 54.0 Cg_endo -69.73 79.93 0.91 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.667 2.245 . . . . 65.349999999999994 112.368 179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -95.81 -37.18 5.05 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.748 -0.739 . . . . 63.140000000000001 112.47 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 11.5 pttp -59.34 -43.62 92.74 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.771 0.319 . . . . 75.140000000000001 110.875 -179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -81.18 -33.31 33.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.216 -0.447 . . . . 73.25 110.846 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.595 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -54.87 169.64 0.21 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.252 -0.431 . . . . 61.219999999999999 111.107 179.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 34.0 t -127.11 110.83 23.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.239 -0.437 . . . . 74.430000000000007 111.144 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.668 HD13 ' HB3' ' A' ' 496' ' ' LEU . 56.5 mt -92.91 128.76 44.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.19 -0.459 . . . . 71.420000000000002 111.12 179.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -113.95 136.54 52.78 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.175 -0.466 . . . . 72.349999999999994 111.138 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -99.16 132.93 44.13 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.192 -0.458 . . . . 72.510000000000005 110.881 -179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 33.1 t -139.54 111.42 5.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.165 -0.47 . . . . 72.329999999999998 111.105 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.78 98.52 8.5 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 74.040000000000006 110.896 -179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.6 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -65.08 161.22 50.1 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.609 0.718 . . . . 74.209999999999994 111.112 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.6 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 54.0 Cg_endo -69.72 71.13 1.52 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.699 2.266 . . . . 72.219999999999999 112.372 -179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 1.8 t 177.81 136.24 0.07 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 74.549999999999997 111.161 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -93.96 38.63 1.08 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.251 -0.431 . . . . 64.409999999999997 111.064 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -124.42 -35.28 2.79 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.206 -0.452 . . . . 73.439999999999998 111.092 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -139.85 177.26 8.08 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.277 -0.42 . . . . 74.540000000000006 110.906 -179.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -141.45 152.65 44.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.107 -0.497 . . . . 63.539999999999999 110.911 -179.981 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . 0.41 ' HG2' HD12 ' A' ' 553' ' ' LEU . 9.7 mt-10 -111.67 130.97 55.6 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 75.340000000000003 110.876 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.429 ' HE2' HG22 ' A' ' 493' ' ' VAL . 6.0 m-85 -132.93 135.41 45.53 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 71.200000000000003 110.87 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.836 HD21 ' HB1' ' A' ' 482' ' ' ALA . 2.6 tm? -103.92 112.22 25.1 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.13 -0.486 . . . . 64.299999999999997 110.893 -179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.796 HG12 HD21 ' A' ' 529' ' ' LEU . 14.5 t -95.28 111.08 25.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.131 -0.486 . . . . 71.299999999999997 111.141 179.858 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.474 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 14.1 tttm -87.76 115.18 25.03 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.179 -0.464 . . . . 72.120000000000005 110.904 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.796 HD21 HG12 ' A' ' 527' ' ' VAL . 6.1 mt -131.78 154.88 81.92 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.644 0.735 . . . . 73.209999999999994 110.899 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . 0.408 ' HD2' ' HB3' ' A' ' 529' ' ' LEU . 53.9 Cg_endo -69.71 162.73 40.92 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.707 2.271 . . . . 65.310000000000002 112.379 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 103.91 1.23 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.698 2.266 . . . . 70.349999999999994 112.392 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.0 mt -107.22 -170.96 1.79 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.246 -0.434 . . . . 73.510000000000005 110.935 179.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 1.3 t -71.83 150.43 44.32 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.209 -0.451 . . . . 64.120000000000005 110.874 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -51.94 -48.92 64.03 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 64.540000000000006 110.904 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 11.7 mm-40 -60.55 -48.41 81.89 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 73.319999999999993 110.888 -179.89 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 49.4 mmm-85 -54.47 -57.96 9.31 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.157 -0.474 . . . . 62.310000000000002 110.885 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -52.86 -52.58 56.73 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.162 -0.472 . . . . 62.340000000000003 110.908 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.8 mt -56.36 -37.12 69.62 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.148 -0.478 . . . . 64.0 110.928 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -64.84 -46.16 83.07 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.162 -0.472 . . . . 64.230000000000004 110.872 179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.615 HD22 ' CD2' ' A' ' 505' ' ' PHE . 24.9 tp -60.91 -51.13 70.58 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.155 -0.475 . . . . 74.140000000000001 110.907 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 64.3 mm-40 -57.36 -50.33 73.32 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 64.439999999999998 110.857 179.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 55.4 mtm180 -58.0 -51.88 67.82 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.175 -0.466 . . . . 74.140000000000001 110.867 -179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . 0.522 HD22 ' HE1' ' A' ' 499' ' ' PHE . 2.6 tt -52.83 -44.78 66.96 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.229 -0.441 . . . . 74.010000000000005 110.88 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -60.05 -56.42 21.85 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.194 -0.457 . . . . 71.420000000000002 110.898 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.23 -13.14 59.88 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.161 -0.472 . . . . 73.129999999999995 111.103 179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 23.2 t -79.63 -57.77 3.52 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.24 -0.436 . . . . 75.310000000000002 110.803 -179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -88.42 -52.12 5.36 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.093 -0.503 . . . . 73.209999999999994 110.874 -179.913 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.0 tp -67.82 -12.51 60.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.179 -0.464 . . . . 74.319999999999993 110.912 -179.987 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 20.4 mmmt 57.09 23.39 8.42 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.185 -0.462 . . . . 63.210000000000001 110.924 179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -68.65 176.93 2.7 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.195 -0.457 . . . . 64.200000000000003 111.071 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.7 m -145.09 110.96 5.44 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 63.109999999999999 111.098 -179.914 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.5 t -54.14 135.11 16.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.206 -0.452 . . . . 64.129999999999995 111.1 179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . 0.41 HD12 ' HG2' ' A' ' 524' ' ' GLU . 77.6 mt -120.79 -47.64 2.3 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.164 -0.471 . . . . 55.039999999999999 110.877 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . 0.546 ' HB3' ' HB ' ' A' ' 484' ' ' THR . . . -133.88 165.84 24.06 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.162 -0.472 . . . . 65.120000000000005 111.069 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 80.3 p -171.69 138.48 1.11 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.203 -0.453 . . . . 53.409999999999997 110.84 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.558 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 6.0 pt-20 -140.91 139.7 34.39 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.144 -0.48 . . . . 74.329999999999998 110.888 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 88.7 m -124.95 146.04 49.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.165 -0.47 . . . . 74.409999999999997 111.141 -179.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 22.0 t -134.84 123.7 41.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.225 -0.443 . . . . 75.510000000000005 111.1 179.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.282 0 C-N-CA 120.754 -0.736 . . . . 71.540000000000006 112.504 -179.978 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 2.9 mmt . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.812 0.339 . . . . 75.230000000000004 110.855 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 28.8 m -76.81 134.65 28.34 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.226 -0.443 . . . . 75.430000000000007 111.128 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -153.18 75.96 0.23 Allowed Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.718 -0.753 . . . . 21.219999999999999 112.474 180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -150.02 151.31 33.08 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.822 0.344 . . . . 71.540000000000006 110.943 -179.894 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 25.6 t30 -129.4 144.3 51.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.223 -0.444 . . . . 74.099999999999994 110.869 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 25.2 p90 -148.01 135.72 20.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.129 -0.487 . . . . 73.140000000000001 110.921 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 20.0 m -120.64 121.46 38.38 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.116 -0.493 . . . . 42.520000000000003 110.827 -179.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 41.6 mt -117.27 141.65 34.85 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.326 0 CA-C-N 116.116 -0.493 . . . . 75.349999999999994 111.161 179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 10.1 t0 -166.03 119.83 1.14 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 74.430000000000007 110.877 179.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 21.6 p90 -123.39 127.29 48.25 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 63.409999999999997 110.88 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 20.2 m -106.74 70.05 0.8 Allowed 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.117 -0.492 . . . . 72.030000000000001 111.137 -179.911 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 128.78 -83.26 0.33 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.74 -0.743 . . . . 72.219999999999999 112.51 -179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 138.1 153.75 6.34 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.723 -0.751 . . . . 60.140000000000001 112.476 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 94.4 m -128.72 110.26 12.04 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 120.746 0.308 . . . . 74.120000000000005 111.154 -179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.423 ' HB3' ' HG2' ' A' ' 556' ' ' GLU . . . -96.81 130.1 44.14 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 72.010000000000005 111.094 179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -117.56 116.45 27.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.217 -0.447 . . . . 75.409999999999997 110.923 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 1.2 m -98.81 110.04 22.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 72.099999999999994 111.158 -179.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.488 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.9 pt? -133.37 145.64 50.53 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.215 -0.448 . . . . 62.420000000000002 110.89 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 2.8 mtm180 -89.29 137.72 32.08 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.175 -0.466 . . . . 72.319999999999993 110.911 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . 0.575 ' HB3' ' CD2' ' A' ' 525' ' ' PHE . . . -133.27 167.09 21.02 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 74.230000000000004 111.097 179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 6.5 mt-10 -65.35 160.61 57.32 Favored Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.667 0.746 . . . . 71.430000000000007 110.862 -179.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -12.79 33.6 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.677 2.251 . . . . 51.020000000000003 112.334 -179.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -81.78 -37.29 27.38 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.211 -0.45 . . . . 64.530000000000001 110.861 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 87.8 t -70.75 120.67 19.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.158 -0.473 . . . . 60.100000000000001 111.143 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 10.2 mt-10 -113.49 178.72 4.18 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.145 -0.48 . . . . 73.230000000000004 110.883 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 54.1 t -53.46 -48.66 57.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 70.230000000000004 111.146 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 1.3 pp20? -51.88 -42.08 62.41 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.133 -0.485 . . . . 64.25 110.875 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 69.6 m -67.84 -39.97 83.8 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.152 -0.476 . . . . 64.140000000000001 111.139 -179.934 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.574 ' HB3' HD13 ' A' ' 512' ' ' ILE . 2.3 mt -61.87 -50.94 70.21 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.235 -0.439 . . . . 70.219999999999999 110.899 -179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 16.9 ptp180 -64.79 -42.21 95.23 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.189 -0.459 . . . . 74.019999999999996 110.859 179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 28.0 mtp180 -60.04 -40.51 89.62 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.208 -0.451 . . . . 73.430000000000007 110.885 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . 0.563 ' HE1' HD22 ' A' ' 543' ' ' LEU . 15.0 t80 -70.9 -43.27 68.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.162 -0.472 . . . . 63.340000000000003 110.871 -179.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 34.1 mt -57.78 -49.52 76.32 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.15 -0.477 . . . . 72.120000000000005 110.881 -179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.79 -37.96 73.34 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.223 -0.444 . . . . 71.409999999999997 110.872 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 30.8 tp10 -56.38 -49.18 75.2 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.192 -0.458 . . . . 71.109999999999999 110.865 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.91 -24.52 65.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 72.530000000000001 110.914 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.03 -16.88 20.23 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.755 -0.736 . . . . 53.509999999999998 112.491 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.539 ' CD2' HD22 ' A' ' 540' ' ' LEU . 16.9 m-85 -60.94 160.24 21.94 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.658 0.742 . . . . 64.120000000000005 110.876 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . 0.498 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 53.7 Cg_endo -69.73 86.42 0.58 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.724 2.283 . . . . 60.340000000000003 112.333 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -102.04 -30.54 5.69 Favored Glycine 0 N--CA 1.451 -0.34 0 C-N-CA 120.747 -0.739 . . . . 72.219999999999999 112.452 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 22.4 pttm -63.94 -42.22 97.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.766 0.317 . . . . 50.409999999999997 110.871 -179.941 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -85.53 -27.19 25.75 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.249 -0.432 . . . . 73.0 110.854 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.626 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -62.34 165.6 5.84 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 62.439999999999998 111.104 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -126.83 111.28 25.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.223 -0.444 . . . . 73.5 111.092 179.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.574 HD13 ' HB3' ' A' ' 496' ' ' LEU . 54.3 mt -92.8 139.5 17.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.18 -0.464 . . . . 73.439999999999998 111.128 179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -135.47 143.68 45.99 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.193 -0.458 . . . . 73.030000000000001 111.122 179.984 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 7.2 pt20 -99.3 143.23 29.79 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.205 -0.452 . . . . 74.310000000000002 110.883 -179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 76.8 t -139.01 115.11 9.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.207 -0.452 . . . . 62.329999999999998 111.119 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 13.4 tp60 -74.63 127.3 32.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.176 -0.465 . . . . 63.549999999999997 110.868 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.586 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -110.41 160.22 29.25 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.563 0.697 . . . . 70.530000000000001 111.135 179.898 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.586 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.9 Cg_endo -69.76 74.48 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.692 2.262 . . . . 60.450000000000003 112.356 -179.935 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.576 HG23 ' O ' ' A' ' 522' ' ' TYR . 2.0 t 179.17 141.58 0.11 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.185 -0.462 . . . . 73.340000000000003 111.122 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -99.56 27.41 5.33 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.218 -0.446 . . . . 63.020000000000003 111.089 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.48 -35.02 3.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 43.219999999999999 111.068 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.576 ' O ' HG23 ' A' ' 519' ' ' THR . 13.1 m-85 -146.8 159.98 42.83 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.275 -0.421 . . . . 73.510000000000005 110.943 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 4.6 ptt180 -131.18 165.02 24.25 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.09 -0.505 . . . . 74.030000000000001 110.867 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -92.84 139.94 30.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.199 -0.455 . . . . 64.019999999999996 110.869 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.575 ' CD2' ' HB3' ' A' ' 487' ' ' ALA . 10.8 m-85 -128.83 122.86 31.37 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.13 -0.486 . . . . 71.409999999999997 110.851 -179.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.41 HD22 ' HA ' ' A' ' 526' ' ' LEU . 0.5 OUTLIER -102.31 105.54 16.19 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.104 -0.498 . . . . 64.409999999999997 110.916 -179.986 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.54 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.4 t -96.82 133.52 37.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.238 -0.437 . . . . 63.25 111.084 179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.492 ' O ' HD23 ' A' ' 529' ' ' LEU . 18.9 tttp -108.55 108.1 18.87 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.126 -0.488 . . . . 61.439999999999998 110.929 179.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.626 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.6 mt -131.17 154.44 81.99 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.577 0.703 . . . . 75.519999999999996 110.898 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 162.16 43.14 Favored 'Trans proline' 0 N--CA 1.465 -0.181 0 C-N-CA 122.678 2.252 . . . . 72.510000000000005 112.383 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 113.92 3.53 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.637 2.224 . . . . 74.409999999999997 112.354 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 1.2 mt -115.37 -171.19 1.91 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.203 -0.453 . . . . 60.0 110.907 179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -74.32 154.98 38.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.18 -0.463 . . . . 62.130000000000003 110.848 -179.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . 0.497 ' N ' HH21 ' A' ' 537' ' ' ARG . 4.6 m-20 -51.67 -47.11 63.94 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.101 -0.5 . . . . 70.109999999999999 110.855 179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 20.1 mt-10 -59.78 -50.17 74.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.211 -0.449 . . . . 71.230000000000004 110.863 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 10.2 mpt_? -50.88 -59.11 4.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.153 -0.476 . . . . 71.439999999999998 110.897 -179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . 0.497 HH21 ' N ' ' A' ' 534' ' ' ASP . 79.4 mtm180 -53.51 -52.51 59.37 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.16 -0.473 . . . . 72.310000000000002 110.864 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.6 mt -54.38 -39.32 67.1 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.136 -0.483 . . . . 73.239999999999995 110.931 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 28.5 tp10 -67.23 -47.34 71.09 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.174 -0.467 . . . . 72.430000000000007 110.879 179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.539 HD22 ' CD2' ' A' ' 505' ' ' PHE . 21.7 tp -60.01 -51.09 71.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 74.140000000000001 110.92 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -59.47 -48.33 82.07 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.171 -0.468 . . . . 73.299999999999997 110.939 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 23.8 mtp180 -60.13 -53.52 56.75 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.137 -0.483 . . . . 73.510000000000005 110.869 -179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . 0.563 HD22 ' HE1' ' A' ' 499' ' ' PHE . 4.0 tt -52.9 -44.03 66.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.205 -0.452 . . . . 74.340000000000003 110.902 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 6.0 m-85 -60.39 -56.48 20.95 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.251 -0.431 . . . . 73.340000000000003 110.875 179.938 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.36 -13.2 60.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.19 -0.459 . . . . 72.530000000000001 111.103 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -79.52 -57.34 3.74 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.236 -0.438 . . . . 72.409999999999997 110.898 -179.852 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 51.2 mm-40 -88.33 -52.24 5.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.112 -0.495 . . . . 71.109999999999999 110.914 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 2.1 tp -67.88 -12.35 60.49 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.117 -0.492 . . . . 33.130000000000003 110.945 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 19.4 mmmt 57.44 23.22 8.79 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.182 -0.463 . . . . 71.549999999999997 110.893 179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -66.99 179.44 1.13 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.223 -0.444 . . . . 63.200000000000003 111.113 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 61.5 m -139.67 110.99 7.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.235 -0.439 . . . . 43.219999999999999 111.188 -179.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 21.9 t -59.41 114.52 0.93 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.206 -0.452 . . . . 74.109999999999999 111.145 179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . . . . . . . . . 12.2 mt -90.92 -51.66 5.24 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.171 -0.468 . . . . 74.439999999999998 110.856 -179.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -162.0 174.21 13.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.194 -0.457 . . . . 34.350000000000001 111.092 179.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 90.7 p -163.06 148.43 11.72 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.214 -0.448 . . . . 74.310000000000002 110.887 -179.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.423 ' HG2' ' HB3' ' A' ' 482' ' ' ALA . 11.6 pt-20 -136.15 128.74 30.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.169 -0.469 . . . . 70.030000000000001 110.889 -179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 61.7 m -116.31 145.95 42.79 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.121 -0.49 . . . . 54.520000000000003 111.15 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 23.9 t -125.14 114.46 40.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 72.219999999999999 111.097 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.315 0 C-N-CA 120.732 -0.747 . . . . 32.109999999999999 112.486 179.969 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.129 0 CA-C-O 120.813 0.34 . . . . 72.430000000000007 110.85 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 11.5 p -81.26 -28.63 10.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 64.450000000000003 111.13 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 58.36 -150.58 33.54 Favored Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.722 -0.751 . . . . 63.299999999999997 112.477 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 46.2 m-85 -127.5 158.79 36.46 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.899 0.381 . . . . 73.439999999999998 110.884 -179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 4.3 t30 -99.34 121.05 40.56 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.193 -0.458 . . . . 72.140000000000001 110.912 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -81.18 -175.39 5.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.22 -0.445 . . . . 74.140000000000001 110.958 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 8.4 m -138.45 115.15 10.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.147 -0.478 . . . . 73.219999999999999 110.86 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . 0.715 HG22 ' H ' ' A' ' 477' ' ' PHE . 28.4 mm -98.96 136.78 28.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.145 -0.48 . . . . 34.299999999999997 111.122 179.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -77.89 -21.9 50.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.155 -0.475 . . . . 71.310000000000002 110.863 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.715 ' H ' HG22 ' A' ' 475' ' ' ILE . 41.5 p90 -110.46 175.09 5.56 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.19 -0.459 . . . . 74.219999999999999 110.907 -179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 92.0 m -160.83 143.72 12.94 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.136 -0.483 . . . . 72.319999999999993 111.129 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 176.26 -107.58 0.24 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.774 -0.727 . . . . 65.219999999999999 112.502 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -172.64 160.32 31.37 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.719 -0.753 . . . . 75.420000000000002 112.478 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . 0.513 HG23 ' OG1' ' A' ' 557' ' ' THR . 25.6 m -131.6 107.35 8.78 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.8 0.333 . . . . 73.219999999999999 111.162 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.595 ' HB3' ' CG ' ' A' ' 556' ' ' GLU . . . -95.0 115.15 27.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 74.030000000000001 111.084 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 11.3 m-85 -104.69 113.03 26.35 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 74.420000000000002 110.93 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . . . . . . . . . 5.2 m -94.87 110.09 22.0 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.129 -0.487 . . . . 65.400000000000006 111.127 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.458 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -134.41 143.28 47.5 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.215 -0.448 . . . . 70.349999999999994 110.939 179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.415 ' HD3' HD11 ' A' ' 553' ' ' LEU . 24.3 mtp180 -90.21 142.15 28.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.21 -0.45 . . . . 74.420000000000002 110.834 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . 0.485 ' HB3' ' CD2' ' A' ' 525' ' ' PHE . . . -137.15 168.54 19.4 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.172 -0.467 . . . . 73.129999999999995 111.065 179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -63.94 160.57 45.67 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.617 0.722 . . . . 64.019999999999996 110.908 -179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -14.12 35.49 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.666 2.244 . . . . 75.430000000000007 112.322 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -80.17 -37.33 33.58 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.214 -0.448 . . . . 71.409999999999997 110.904 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 63.9 t -69.2 125.64 27.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.202 -0.453 . . . . 74.120000000000005 111.169 179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -117.99 175.35 5.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.182 -0.463 . . . . 43.210000000000001 110.873 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 60.9 t -51.79 -48.9 37.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.167 -0.47 . . . . 74.340000000000003 111.114 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 16.7 mt-10 -52.0 -40.38 60.88 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 54.149999999999999 110.918 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 95.2 m -66.47 -43.23 86.01 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.134 -0.485 . . . . 72.400000000000006 111.111 -179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.646 ' CB ' HD13 ' A' ' 512' ' ' ILE . 7.2 mt -61.78 -51.04 69.93 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.213 -0.449 . . . . 64.340000000000003 110.924 179.952 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 6.4 ptp180 -65.02 -35.09 80.06 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.216 -0.447 . . . . 72.540000000000006 110.841 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 42.6 mtp180 -64.19 -45.09 89.87 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.244 -0.435 . . . . 74.310000000000002 110.859 -179.877 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -71.15 -36.92 72.24 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.182 -0.463 . . . . 71.219999999999999 110.9 -179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.456 HD12 HD11 ' A' ' 512' ' ' ILE . 29.2 mt -62.11 -50.43 71.92 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.16 -0.473 . . . . 71.109999999999999 110.962 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -71.08 -37.87 72.44 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 70.239999999999995 110.873 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -58.09 -48.95 78.62 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.167 -0.469 . . . . 73.450000000000003 110.905 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 34.3 mmtt -67.88 -24.05 65.19 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 72.549999999999997 110.865 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 113.91 -18.6 19.11 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.745 -0.741 . . . . 63.009999999999998 112.472 179.938 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.511 ' CD2' HD22 ' A' ' 540' ' ' LEU . 15.9 m-85 -60.74 160.24 20.92 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.684 0.754 . . . . 62.530000000000001 110.884 -179.852 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . 0.462 ' O ' ' HB2' ' A' ' 510' ' ' ALA . 53.8 Cg_endo -69.77 90.08 0.52 Allowed 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.683 2.255 . . . . 61.200000000000003 112.362 -179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -104.95 -39.26 2.35 Favored Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.788 -0.72 . . . . 34.439999999999998 112.501 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 17.1 mtpp -57.25 -52.08 66.77 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.728 0.299 . . . . 75.25 110.883 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 8.4 mm-40 -73.14 -36.27 66.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.264 -0.426 . . . . 71.420000000000002 110.893 179.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.636 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -54.14 167.06 0.32 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 65.239999999999995 111.1 179.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.9 t -126.72 111.12 24.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.195 -0.457 . . . . 63.310000000000002 111.163 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.646 HD13 ' CB ' ' A' ' 496' ' ' LEU . 74.7 mt -96.02 127.05 48.44 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.178 -0.465 . . . . 62.130000000000003 111.141 179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 2.1 m -122.13 148.21 45.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.464 . . . . 61.439999999999998 111.193 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 24.3 pt20 -104.41 140.35 38.05 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.239 -0.437 . . . . 72.340000000000003 110.925 -179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 80.8 t -136.43 111.91 11.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.188 -0.46 . . . . 65.040000000000006 111.177 179.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -73.09 110.93 7.75 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.191 -0.459 . . . . 74.329999999999998 110.924 -179.956 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.561 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -91.51 160.25 37.16 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.547 0.689 . . . . 61.310000000000002 111.104 179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.561 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.6 Cg_endo -69.79 74.55 1.29 Allowed 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.673 2.249 . . . . 74.219999999999999 112.346 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.62 HG23 ' O ' ' A' ' 522' ' ' TYR . 1.9 t -177.04 137.37 0.23 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.224 -0.444 . . . . 73.319999999999993 111.149 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -95.42 25.8 4.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.2 -0.454 . . . . 55.409999999999997 111.101 179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -122.38 -35.15 3.16 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.234 -0.439 . . . . 62.009999999999998 111.072 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.62 ' O ' HG23 ' A' ' 519' ' ' THR . 13.4 m-85 -144.58 166.77 24.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 72.200000000000003 110.906 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 7.2 ptm180 -136.32 160.23 39.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.119 -0.492 . . . . 72.109999999999999 110.853 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 5.1 mt-10 -88.97 138.39 31.45 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.172 -0.467 . . . . 51.329999999999998 110.906 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.485 ' CD2' ' HB3' ' A' ' 487' ' ' ALA . 10.9 m-85 -128.76 122.2 30.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.16 -0.473 . . . . 54.140000000000001 110.881 -179.904 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.5 HD11 ' HB1' ' A' ' 482' ' ' ALA . 0.2 OUTLIER -99.3 104.82 16.76 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.143 -0.48 . . . . 74.219999999999999 110.905 -179.983 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.578 HG12 HD21 ' A' ' 529' ' ' LEU . 21.6 t -96.57 111.86 27.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.174 -0.466 . . . . 71.230000000000004 111.112 179.82 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.509 ' O ' HD23 ' A' ' 529' ' ' LEU . 17.3 ttmt -91.38 109.05 20.32 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.148 -0.478 . . . . 73.150000000000006 110.86 179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.636 HD23 ' HB1' ' A' ' 510' ' ' ALA . 6.0 mt -132.53 154.42 81.52 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.618 0.723 . . . . 74.349999999999994 110.921 179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 162.19 43.04 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.714 2.276 . . . . 72.519999999999996 112.349 179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 103.88 1.23 Allowed 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.684 2.256 . . . . 74.019999999999996 112.344 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 5.0 mt -101.06 -171.34 1.98 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.178 -0.464 . . . . 74.209999999999994 110.884 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 30.0 t -71.12 151.25 44.65 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 72.310000000000002 110.875 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -51.75 -51.14 58.43 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 63.020000000000003 110.873 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -61.14 -45.41 94.76 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.242 -0.436 . . . . 71.299999999999997 110.924 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 11.6 mmt180 -57.38 -58.07 9.9 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.133 -0.485 . . . . 64.140000000000001 110.87 -179.892 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 59.1 mtp180 -52.82 -52.15 58.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.187 -0.461 . . . . 72.310000000000002 110.908 -179.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 2.4 mt -56.86 -48.12 78.85 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.18 -0.464 . . . . 71.430000000000007 110.9 179.989 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 83.9 tt0 -55.8 -41.63 74.44 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.208 -0.451 . . . . 72.299999999999997 110.908 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.511 HD22 ' CD2' ' A' ' 505' ' ' PHE . 34.5 tp -66.38 -39.71 89.24 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.136 -0.484 . . . . 64.230000000000004 110.904 -179.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 21.8 mt-10 -61.23 -55.4 32.51 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.193 -0.458 . . . . 74.450000000000003 110.836 179.973 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 1.6 ptt85 -59.07 -47.83 83.82 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.157 -0.474 . . . . 75.219999999999999 110.849 -179.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 5.5 tt -53.59 -47.34 70.24 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.233 -0.439 . . . . 75.409999999999997 110.898 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.2 m-85 -60.63 -56.04 26.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.231 -0.44 . . . . 73.109999999999999 110.867 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -64.48 -14.09 55.35 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.157 -0.474 . . . . 63.030000000000001 111.138 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.03 -59.28 2.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 75.430000000000007 110.798 -179.734 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 48.7 mm-40 -86.23 -52.55 5.58 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.159 -0.473 . . . . 74.430000000000007 110.87 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.44 HD23 ' HB2' ' A' ' 550' ' ' ALA . 1.2 tp -67.53 -12.67 60.88 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.198 -0.456 . . . . 61.039999999999999 110.93 -179.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 57.27 23.2 8.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.161 -0.472 . . . . 72.129999999999995 110.9 179.836 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . 0.44 ' HB2' HD23 ' A' ' 548' ' ' LEU . . . -68.68 175.4 3.56 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 71.409999999999997 111.075 179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 88.9 m -137.55 111.18 8.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.195 -0.457 . . . . 64.510000000000005 111.148 -179.948 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 43.4 t -59.2 111.81 0.56 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 CA-C-N 116.196 -0.456 . . . . 73.439999999999998 111.167 179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . 0.415 HD11 ' HD3' ' A' ' 486' ' ' ARG . 12.1 mt -90.15 -51.96 5.19 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.176 -0.465 . . . . 54.549999999999997 110.881 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -154.4 175.12 13.95 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.175 -0.466 . . . . 74.150000000000006 111.09 179.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 91.9 p -163.72 139.34 6.43 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.188 -0.46 . . . . 64.230000000000004 110.837 -179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.595 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 3.7 pt-20 -134.02 147.75 51.01 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.146 -0.479 . . . . 62.149999999999999 110.843 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . 0.513 ' OG1' HG23 ' A' ' 481' ' ' THR . 63.1 m -142.9 139.69 30.88 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.091 -0.504 . . . . 44.100000000000001 111.126 -179.915 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 23.6 t -102.6 116.02 45.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.251 -0.431 . . . . 74.239999999999995 111.139 179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.33 0 C-N-CA 120.741 -0.742 . . . . 64.129999999999995 112.503 -179.989 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.828 0.347 . . . . 73.400000000000006 110.856 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 27.9 m -120.99 -177.15 1.25 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.193 -0.458 . . . . 74.549999999999997 111.124 179.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . -149.23 90.91 0.14 Allowed Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.754 -0.736 . . . . 64.430000000000007 112.48 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 16.5 m-85 -130.75 98.82 4.74 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.876 0.369 . . . . 71.400000000000006 110.877 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 5.6 p-10 -163.44 151.87 13.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.164 -0.471 . . . . 64.219999999999999 110.865 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 18.1 m-85 -123.9 -176.22 3.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.22 -0.445 . . . . 72.120000000000005 110.914 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 4.1 t -90.78 168.5 11.69 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.1 -0.5 . . . . 74.299999999999997 110.88 -179.88 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . 0.706 HG22 ' H ' ' A' ' 477' ' ' PHE . 29.5 mm -94.62 137.24 23.62 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.136 -0.484 . . . . 73.319999999999993 111.143 179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -80.91 -21.51 40.49 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.203 -0.453 . . . . 71.439999999999998 110.82 179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . 0.706 ' H ' HG22 ' A' ' 475' ' ' ILE . 74.5 m-85 -92.79 152.42 19.47 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 72.420000000000002 110.908 -179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 1.7 m -136.51 135.66 38.72 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 75.310000000000002 111.113 -179.875 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . -160.05 -106.46 0.22 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.797 -0.716 . . . . 73.230000000000004 112.508 179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . -159.95 148.31 16.62 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.766 -0.731 . . . . 52.329999999999998 112.498 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 1.6 m -123.94 109.21 13.29 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.776 0.322 . . . . 74.540000000000006 111.175 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . 0.74 ' HB3' ' CG ' ' A' ' 556' ' ' GLU . . . -94.87 121.98 37.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.23 -0.441 . . . . 32.43 111.103 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 8.9 m-85 -115.95 114.6 24.86 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.233 -0.439 . . . . 72.310000000000002 110.934 -179.874 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.482 HG23 ' CD2' ' A' ' 526' ' ' LEU . 1.2 m -100.06 113.55 26.24 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.095 -0.502 . . . . 75.409999999999997 111.158 -179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.491 HD23 ' H ' ' A' ' 485' ' ' LEU . 1.8 pt? -131.64 143.86 50.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.199 -0.455 . . . . 75.340000000000003 110.861 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . . . . . . . . . 12.5 ttm-85 -92.14 145.25 24.65 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.174 -0.467 . . . . 71.140000000000001 110.846 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . . . . . . . . . . . -148.66 169.76 19.65 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.163 -0.471 . . . . 72.420000000000002 111.139 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 5.0 mt-10 -64.97 160.8 52.97 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.657 0.741 . . . . 74.340000000000003 110.925 -179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 -10.74 29.3 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.691 2.261 . . . . 74.450000000000003 112.385 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -73.85 -46.45 44.82 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.171 -0.468 . . . . 71.540000000000006 110.853 -179.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . 0.631 HG11 HD21 ' A' ' 548' ' ' LEU . 67.0 t -66.92 138.86 22.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.197 -0.456 . . . . 73.109999999999999 111.121 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -133.73 179.71 6.06 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.194 -0.457 . . . . 64.200000000000003 110.903 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 93.6 t -51.54 -47.93 36.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.183 -0.462 . . . . 71.319999999999993 111.093 -179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -51.65 -39.99 59.15 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.400000000000006 110.879 -179.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 96.2 m -71.31 -35.53 71.29 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.154 -0.476 . . . . 64.540000000000006 111.141 -179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.66 ' CB ' HD13 ' A' ' 512' ' ' ILE . 4.1 mt -67.32 -45.57 76.05 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.235 -0.439 . . . . 71.219999999999999 110.898 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 14.6 ptt180 -69.47 -46.26 67.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 74.219999999999999 110.898 179.943 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -64.12 -32.47 74.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.17 -0.468 . . . . 73.319999999999993 110.891 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 39.6 t80 -73.28 -46.99 46.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.197 -0.456 . . . . 72.120000000000005 110.85 -179.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 43.4 mt -61.08 -42.53 98.66 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.172 -0.467 . . . . 75.030000000000001 110.941 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 24.5 pt-20 -73.05 -37.59 66.8 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.167 -0.47 . . . . 60.549999999999997 110.891 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.2 tp10 -60.34 -48.98 79.43 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 72.400000000000006 110.88 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . 0.596 ' HE2' HD13 ' A' ' 543' ' ' LEU . 28.8 mmmt -68.97 -23.78 64.16 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.155 -0.475 . . . . 72.340000000000003 110.875 179.982 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.12 -17.6 19.41 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.746 -0.74 . . . . 70.450000000000003 112.493 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . . . . . . . . . 18.7 m-85 -63.05 160.16 41.11 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.593 0.711 . . . . 71.25 110.943 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 95.57 0.56 Allowed 'Trans proline' 0 C--N 1.341 0.133 0 C-N-CA 122.689 2.259 . . . . 64.209999999999994 112.325 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -111.15 -37.24 1.68 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.695 -0.764 . . . . 52.43 112.482 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 10.6 ptmm? -63.34 -42.56 98.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.791 0.329 . . . . 64.430000000000007 110.874 -179.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 11.1 mt-10 -79.91 -38.43 32.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.199 -0.455 . . . . 73.420000000000002 110.938 179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.624 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -55.94 171.44 0.24 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.126 -0.488 . . . . 73.430000000000007 111.115 179.956 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 56.4 t -127.08 118.08 49.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.272 -0.422 . . . . 62.43 111.159 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.66 HD13 ' CB ' ' A' ' 496' ' ' LEU . 50.7 mt -96.82 141.84 14.96 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.197 -0.456 . . . . 74.329999999999998 111.151 179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -138.89 138.72 37.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.129999999999995 111.173 179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -88.53 143.17 27.14 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.265 -0.425 . . . . 53.109999999999999 110.956 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 83.7 t -135.77 104.61 4.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.234 -0.439 . . . . 75.230000000000004 111.11 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 18.9 tm0? -73.84 102.08 3.94 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.192 -0.458 . . . . 65.400000000000006 110.894 179.992 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -81.92 160.23 63.98 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.595 0.712 . . . . 75.120000000000005 111.089 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.4 Cg_endo -69.78 74.55 1.29 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.629 2.22 . . . . 71.239999999999995 112.356 -179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . . . . . . . . . 4.4 t -175.05 139.68 0.49 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.199 -0.455 . . . . 72.230000000000004 111.187 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -98.63 25.18 6.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.263 -0.426 . . . . 71.129999999999995 111.083 179.873 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -121.85 -34.57 3.35 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.234 -0.439 . . . . 42.210000000000001 111.11 179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -138.6 177.61 7.76 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.242 -0.435 . . . . 74.209999999999994 110.944 -179.872 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 44.2 mtt85 -144.78 153.66 41.89 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.104 -0.498 . . . . 75.510000000000005 110.875 -179.956 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . 0.415 ' HG2' HD12 ' A' ' 553' ' ' LEU . 9.8 mt-10 -92.27 138.74 31.27 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.205 -0.452 . . . . 64.040000000000006 110.878 -179.953 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.474 ' CD1' HD11 ' A' ' 496' ' ' LEU . 9.6 m-85 -122.25 122.77 39.91 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.138 -0.483 . . . . 70.329999999999998 110.868 -179.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.482 ' CD2' HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -100.46 101.48 12.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 71.0 110.944 -179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.565 ' CG1' HD21 ' A' ' 529' ' ' LEU . 19.7 t -95.98 122.7 47.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.17 -0.468 . . . . 55.009999999999998 111.128 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.531 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 0.1 OUTLIER -100.63 109.65 21.73 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.147 -0.478 . . . . 73.319999999999993 110.874 179.946 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.624 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.8 mt -130.77 154.65 81.9 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.583 0.706 . . . . 75.349999999999994 110.915 179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 162.41 42.18 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.66 2.24 . . . . 62.039999999999999 112.379 179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 104.04 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.667 2.245 . . . . 73.420000000000002 112.346 179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.6 mt -103.0 -171.0 1.87 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.236 -0.438 . . . . 65.310000000000002 110.895 179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 21.3 m -75.69 152.59 37.49 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.16 -0.473 . . . . 62.0 110.853 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -51.64 -46.77 63.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.125 -0.489 . . . . 75.239999999999995 110.918 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -61.03 -43.1 99.38 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.164 -0.471 . . . . 73.239999999999995 110.915 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 17.2 mmt180 -62.0 -55.8 25.61 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.129 -0.487 . . . . 75.340000000000003 110.877 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 45.9 mtp180 -52.79 -53.15 52.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.141 -0.482 . . . . 70.150000000000006 110.895 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . 0.567 HD22 HH21 ' A' ' 542' ' ' ARG . 0.8 OUTLIER -55.38 -48.3 74.51 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.129 -0.487 . . . . 73.530000000000001 110.975 -179.988 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -55.55 -41.84 73.81 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.161 -0.472 . . . . 74.230000000000004 110.948 179.867 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . . . . . . . . . 30.4 tp -66.0 -39.2 90.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.082 -0.508 . . . . 74.420000000000002 110.901 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -61.74 -55.63 28.22 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.185 -0.461 . . . . 75.409999999999997 110.919 179.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . 0.567 HH21 HD22 ' A' ' 538' ' ' LEU . 17.2 ptp180 -58.55 -47.95 82.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.096 -0.502 . . . . 64.099999999999994 110.89 -179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . 0.596 HD13 ' HE2' ' A' ' 503' ' ' LYS . 12.2 mt -53.72 -47.92 70.11 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.239999999999995 110.945 179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.0 m-85 -59.62 -56.26 24.15 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.166 -0.47 . . . . 74.219999999999999 110.877 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -65.06 -13.54 58.2 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.149 -0.478 . . . . 73.239999999999995 111.082 179.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -79.77 -59.03 2.89 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.21 -0.45 . . . . 74.409999999999997 110.889 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 18.3 mm-40 -88.2 -52.22 5.34 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.136 -0.484 . . . . 70.030000000000001 110.896 -179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . 0.631 HD21 HG11 ' A' ' 491' ' ' VAL . 0.1 OUTLIER -67.63 -12.73 61.09 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.153 -0.476 . . . . 73.549999999999997 110.991 179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 27.6 mmmt 55.89 24.22 7.32 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 50.009999999999998 110.942 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -72.81 -179.94 3.37 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.232 -0.44 . . . . 72.329999999999998 111.104 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 95.7 m -145.05 111.37 5.64 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.231 -0.441 . . . . 72.219999999999999 111.096 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . . . . . . . . . 38.5 t -52.08 120.23 1.42 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 65.019999999999996 111.138 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . 0.415 HD12 ' HG2' ' A' ' 524' ' ' GLU . 16.0 mt -99.0 -50.91 4.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.168 -0.469 . . . . 72.200000000000003 110.88 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -159.11 174.71 14.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.218 -0.447 . . . . 72.349999999999994 111.131 179.853 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 51.1 p -161.04 163.51 31.53 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.252 -0.431 . . . . 63.0 110.857 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . 0.74 ' CG ' ' HB3' ' A' ' 482' ' ' ALA . 18.5 pt-20 -155.26 136.38 13.86 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.161 -0.472 . . . . 73.219999999999999 110.88 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 2.6 m -130.05 144.27 51.25 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.108 -0.496 . . . . 51.420000000000002 111.157 -179.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 22.0 t -103.68 111.95 35.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.225 -0.443 . . . . 71.230000000000004 111.112 179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.352 0 C-N-CA 120.771 -0.728 . . . . 52.219999999999999 112.511 179.991 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' MET . . . . . . . . . . . . . 6.3 tpt . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.836 0.351 . . . . 70.209999999999994 110.89 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' VAL . . . . . . . . . . . . . 20.3 m -80.95 159.48 4.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 116.248 -0.433 . . . . 73.439999999999998 111.147 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' GLY . . . . . . . . . . . . . . . 170.64 78.74 0.04 OUTLIER Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.748 -0.739 . . . . 74.519999999999996 112.471 179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -111.79 99.03 7.81 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.882 0.373 . . . . 71.299999999999997 110.896 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' ASN . . . . . . . . . . . . . 10.2 m120 -95.63 -48.33 5.85 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.149 -0.478 . . . . 74.430000000000007 110.919 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' TYR . . . . . . . . . . . . . 54.1 p90 -145.27 159.61 42.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.161 -0.472 . . . . 74.530000000000001 110.909 -179.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' SER . . . . . . . . . . . . . 11.1 p -147.69 120.3 8.57 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.124 -0.489 . . . . 54.229999999999997 110.832 -179.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' ILE . . . . . . . . . . . . . 34.8 mm -109.69 143.65 19.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.106 -0.497 . . . . 73.329999999999998 111.116 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' ASP . . . . . . . . . . . . . 11.3 t0 -160.26 108.87 1.69 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.182 -0.463 . . . . 74.230000000000004 110.878 179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -108.83 171.74 7.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.204 -0.453 . . . . 53.219999999999999 110.831 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' THR . . . . . . . . . . . . . 14.9 t -110.96 152.72 26.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.108 -0.496 . . . . 55.409999999999997 111.143 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' GLY . . . . . . . . . . . . . . . 137.59 -86.28 0.23 Allowed Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.718 -0.753 . . . . 64.140000000000001 112.501 179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' GLY . . . . . . . . . . . . . . . 130.8 146.42 5.88 Favored Glycine 0 N--CA 1.451 -0.323 0 C-N-CA 120.735 -0.745 . . . . 54.350000000000001 112.471 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' THR . . . . . . . . . . . . . 9.3 m -125.17 113.65 17.97 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-O 120.811 0.339 . . . . 52.329999999999998 111.133 -179.868 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' ALA . . . . . . . . . . . . . . . -95.06 121.18 36.42 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.466 . . . . 65.120000000000005 111.096 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' TYR . . . . . . . . . . . . . 14.5 m-85 -114.01 110.18 19.64 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.215 -0.448 . . . . 70.310000000000002 110.921 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' THR . . . . . 0.488 HG23 HD22 ' A' ' 526' ' ' LEU . 1.5 m -97.77 120.21 37.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.166 -0.47 . . . . 64.150000000000006 111.123 -179.992 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' LEU . . . . . 0.468 HD23 ' H ' ' A' ' 485' ' ' LEU . 2.1 pt? -136.96 153.2 50.76 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.18 -0.464 . . . . 55.140000000000001 110.888 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' ARG . . . . . 0.529 ' HB2' HD11 ' A' ' 553' ' ' LEU . 2.5 ttm180 -98.89 137.87 36.84 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.2 -0.454 . . . . 63.439999999999998 110.864 179.977 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' ALA . . . . . 0.705 ' HB3' ' CE2' ' A' ' 525' ' ' PHE . . . -146.52 168.06 22.15 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.185 -0.461 . . . . 63.329999999999998 111.104 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' GLU . . . . . . . . . . . . . 4.7 mt-10 -64.56 160.75 49.76 Favored Pre-proline 0 C--N 1.33 -0.262 0 CA-C-O 121.608 0.718 . . . . 63.240000000000002 110.9 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 -15.86 37.08 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.653 2.235 . . . . 75.400000000000006 112.322 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 490' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -66.64 -47.48 72.44 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 74.030000000000001 110.847 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 491' ' ' VAL . . . . . . . . . . . . . 38.7 t -67.87 129.63 32.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 64.329999999999998 111.123 179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -122.6 177.77 5.29 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.138 -0.483 . . . . 72.230000000000004 110.844 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.582 HG13 ' HB ' ' A' ' 512' ' ' ILE . 87.1 t -51.5 -49.53 32.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.129 -0.487 . . . . 73.219999999999999 111.132 179.943 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 494' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -50.78 -40.36 54.9 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.205 -0.452 . . . . 73.530000000000001 110.841 -179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 495' ' ' THR . . . . . . . . . . . . . 91.5 m -70.57 -35.14 72.9 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 73.239999999999995 111.137 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 496' ' ' LEU . . . . . 0.514 ' CB ' HD13 ' A' ' 512' ' ' ILE . 4.5 mt -68.02 -44.19 77.1 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.238 -0.437 . . . . 73.010000000000005 110.887 179.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 497' ' ' ARG . . . . . . . . . . . . . 6.2 ptp180 -69.39 -45.04 70.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 65.450000000000003 110.916 179.988 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 498' ' ' ARG . . . . . . . . . . . . . 10.1 ptm180 -66.48 -32.78 74.36 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.164 -0.471 . . . . 74.439999999999998 110.876 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 36.6 t80 -73.6 -42.67 61.24 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.196 -0.456 . . . . 74.230000000000004 110.916 -179.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 52.9 mt -65.53 -41.56 92.97 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.129 -0.487 . . . . 70.140000000000001 110.934 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -73.07 -37.76 66.69 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.188 -0.46 . . . . 74.129999999999995 110.88 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -64.02 -46.32 84.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.154 -0.476 . . . . 74.530000000000001 110.877 -179.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 503' ' ' LYS . . . . . . . . . . . . . 68.7 mmtt -65.88 -24.76 66.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.178 -0.464 . . . . 73.219999999999999 110.941 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . 114.01 -16.06 20.73 Favored Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.717 -0.754 . . . . 74.219999999999999 112.487 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 505' ' ' PHE . . . . . 0.416 ' CD2' HD22 ' A' ' 540' ' ' LEU . 17.2 m-85 -71.94 160.27 83.15 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.66 0.743 . . . . 73.519999999999996 110.877 -179.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 506' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 98.44 0.69 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.676 2.25 . . . . 51.340000000000003 112.313 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 507' ' ' GLY . . . . . . . . . . . . . . . -116.27 -34.59 1.31 Allowed Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.779 -0.724 . . . . 43.32 112.495 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 508' ' ' LYS . . . . . . . . . . . . . 3.7 mtmp? -62.39 -50.56 71.04 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.779 0.323 . . . . 72.349999999999994 110.907 -179.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 6.9 mt-10 -73.02 -32.85 65.37 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.183 -0.462 . . . . 73.319999999999993 110.897 179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 510' ' ' ALA . . . . . 0.618 ' HB1' HD23 ' A' ' 529' ' ' LEU . . . -59.75 172.94 0.64 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.138 -0.483 . . . . 51.409999999999997 111.097 179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 511' ' ' VAL . . . . . . . . . . . . . 21.7 t -127.03 119.37 52.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.225 -0.443 . . . . 74.230000000000004 111.145 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.582 ' HB ' HG13 ' A' ' 493' ' ' VAL . 44.2 mt -99.28 141.9 15.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.216 -0.447 . . . . 74.439999999999998 111.141 179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 513' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -137.06 134.3 36.37 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.115 -0.493 . . . . 75.319999999999993 111.128 179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 12.5 pm0 -94.89 142.74 27.12 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.215 -0.448 . . . . 72.200000000000003 110.949 179.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 515' ' ' VAL . . . . . . . . . . . . . 91.8 t -138.21 114.33 10.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.231 -0.44 . . . . 74.340000000000003 111.183 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 516' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.08 113.01 10.78 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.169 -0.469 . . . . 75.099999999999994 110.88 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 517' ' ' ALA . . . . . 0.577 ' HB1' ' HD2' ' A' ' 518' ' ' PRO . . . -91.76 160.34 36.43 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.616 0.722 . . . . 54.439999999999998 111.055 179.929 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 518' ' ' PRO . . . . . 0.577 ' HD2' ' HB1' ' A' ' 517' ' ' ALA . 53.9 Cg_endo -69.75 74.43 1.28 Allowed 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.673 2.249 . . . . 75.530000000000001 112.375 -179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 519' ' ' THR . . . . . 0.56 HG23 ' O ' ' A' ' 522' ' ' TYR . 3.0 t -179.32 141.02 0.16 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 72.450000000000003 111.145 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 520' ' ' ALA . . . . . . . . . . . . . . . -97.33 24.76 6.17 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.253 -0.431 . . . . 44.439999999999998 111.125 179.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -123.63 -35.67 2.87 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.186 -0.461 . . . . 64.420000000000002 111.041 179.982 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 522' ' ' TYR . . . . . 0.56 ' O ' HG23 ' A' ' 519' ' ' THR . 7.4 m-85 -137.58 168.14 20.27 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.218 -0.446 . . . . 74.209999999999994 110.887 -179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 523' ' ' ARG . . . . . . . . . . . . . 10.6 mmt85 -140.67 160.03 40.92 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.094 -0.503 . . . . 63.119999999999997 110.884 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 524' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -90.52 139.48 30.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.148 -0.478 . . . . 64.409999999999997 110.89 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 525' ' ' PHE . . . . . 0.705 ' CE2' ' HB3' ' A' ' 487' ' ' ALA . 89.9 m-85 -128.47 124.63 36.65 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.13 -0.486 . . . . 61.210000000000001 110.859 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 526' ' ' LEU . . . . . 0.488 HD22 HG23 ' A' ' 484' ' ' THR . 0.2 OUTLIER -106.35 104.31 13.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.176 -0.465 . . . . 71.140000000000001 110.907 179.996 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.547 ' CG1' HD21 ' A' ' 529' ' ' LEU . 21.2 t -96.86 127.04 49.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 65.510000000000005 111.154 179.819 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 528' ' ' LYS . . . . . 0.592 ' O ' ' HB1' ' A' ' 510' ' ' ALA . 3.1 tmtm? -106.44 108.32 19.77 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.159 -0.473 . . . . 54.210000000000001 110.885 179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 529' ' ' LEU . . . . . 0.618 HD23 ' HB1' ' A' ' 510' ' ' ALA . 5.3 mt -130.58 154.73 81.76 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.631 0.729 . . . . 43.340000000000003 110.873 179.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 530' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 162.39 42.28 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.675 2.25 . . . . 65.439999999999998 112.331 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 531' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 104.05 1.26 Allowed 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.701 2.267 . . . . 51.109999999999999 112.337 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 532' ' ' LEU . . . . . . . . . . . . . 3.7 mt -103.78 -170.9 1.84 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.257 -0.429 . . . . 63.119999999999997 110.961 179.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 533' ' ' SER . . . . . . . . . . . . . 32.5 t -72.98 151.09 41.95 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.209 -0.45 . . . . 51.329999999999998 110.865 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.06 -46.31 65.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.153 -0.476 . . . . 44.310000000000002 110.82 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 535' ' ' GLU . . . . . . . . . . . . . 71.1 mm-40 -61.11 -53.55 55.66 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.173 -0.467 . . . . 55.350000000000001 110.888 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 42.2 mmt180 -52.04 -55.79 18.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.458 . . . . 75.219999999999999 110.885 -179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 537' ' ' ARG . . . . . . . . . . . . . 25.0 mtp180 -52.93 -53.2 52.97 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 65.030000000000001 110.878 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 538' ' ' LEU . . . . . . . . . . . . . 1.5 mt -55.2 -39.8 70.04 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.172 -0.467 . . . . 74.140000000000001 110.933 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 539' ' ' GLU . . . . . . . . . . . . . 77.7 tt0 -64.21 -42.17 96.73 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.143 -0.48 . . . . 74.540000000000006 110.885 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 540' ' ' LEU . . . . . 0.416 HD22 ' CD2' ' A' ' 505' ' ' PHE . 22.7 tp -64.01 -51.17 65.47 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 70.049999999999997 110.871 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . 0.434 ' OE1' HG22 ' A' ' 552' ' ' VAL . 62.6 mm-40 -57.28 -50.79 71.78 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.171 -0.468 . . . . 74.299999999999997 110.872 179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 542' ' ' ARG . . . . . . . . . . . . . 82.9 mtt180 -57.92 -52.52 65.15 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.137 -0.483 . . . . 74.329999999999998 110.881 -179.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 543' ' ' LEU . . . . . . . . . . . . . 7.5 mt -52.75 -43.5 65.82 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.187 -0.46 . . . . 72.120000000000005 110.925 179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 544' ' ' PHE . . . . . . . . . . . . . 5.7 m-85 -60.86 -56.6 19.29 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.18 -0.464 . . . . 73.519999999999996 110.858 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 545' ' ' ALA . . . . . . . . . . . . . . . -66.09 -13.45 60.07 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.169 -0.469 . . . . 74.219999999999999 111.091 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 546' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -79.7 -57.78 3.5 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.217 -0.447 . . . . 72.430000000000007 110.89 -179.756 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 547' ' ' GLU . . . . . . . . . . . . . 31.3 mm-40 -88.41 -52.32 5.25 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.118 -0.492 . . . . 62.409999999999997 110.863 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 548' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -67.71 -12.67 61.01 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.161 -0.472 . . . . 74.329999999999998 110.913 -179.975 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 549' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER 57.04 23.33 8.28 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.173 -0.467 . . . . 75.019999999999996 110.915 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 550' ' ' ALA . . . . . . . . . . . . . . . -69.32 179.68 1.92 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.227 -0.442 . . . . 71.420000000000002 111.119 179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 551' ' ' THR . . . . . . . . . . . . . 3.0 m -144.09 110.94 5.69 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.201 -0.454 . . . . 75.530000000000001 111.13 -179.897 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 552' ' ' VAL . . . . . 0.434 HG22 ' OE1' ' A' ' 541' ' ' GLU . 39.2 t -53.64 115.59 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.237 -0.438 . . . . 65.230000000000004 111.092 179.96 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 553' ' ' LEU . . . . . 0.529 HD11 ' HB2' ' A' ' 486' ' ' ARG . 72.1 mt -92.51 -45.7 8.0 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.163 -0.471 . . . . 74.25 110.955 179.942 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 554' ' ' ALA . . . . . . . . . . . . . . . -163.11 174.58 12.02 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 111.087 179.765 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 555' ' ' SER . . . . . . . . . . . . . 63.7 p -169.05 149.85 4.36 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.194 -0.457 . . . . 71.219999999999999 110.852 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 556' ' ' GLU . . . . . . . . . . . . . 36.2 mt-10 -138.53 151.37 47.28 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 75.510000000000005 110.91 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 557' ' ' THR . . . . . . . . . . . . . 16.6 m -139.76 136.87 34.56 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.168 -0.469 . . . . 73.030000000000001 111.147 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 558' ' ' VAL . . . . . . . . . . . . . 82.6 t -76.38 100.24 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.225 -0.443 . . . . 54.119999999999997 111.145 179.91 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 559' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.313 0 C-N-CA 120.752 -0.737 . . . . 45.149999999999999 112.523 -179.999 . . . . . . . . 0 0 . 1 stop_ save_